2-(Benzylthio)-3'-chloro-4'-methylacetanilide

IUPAC: 2-benzylsulfanyl-N-(3-chloro-4-methylphenyl)acetamide

C16H16ClNOS

2-(Benzylthio)-3'-chloro-4'-methylacetanilide is a chemical compound with molecular formula C16H16ClNOS and molecular weight 305.8 g/mol .

What is 2-(Benzylthio)-3'-chloro-4'-methylacetanilide?

Molecular Formula
C16H16ClNOS
Molecular Weight
305.80 g/mol

Structure Identifiers

SMILES
CC1=C(C=C(C=C1)NC(=O)CSCC2=CC=CC=C2)Cl
InChI
InChI=1S/C16H16ClNOS/c1-12-7-8-14(9-15(12)17)18-16(19)11-20-10-13-5-3-2-4-6-13/h2-9H,10-11H2,1H3,(H,18,19)
InChIKey
GALULNHYRTZYKP-UHFFFAOYSA-N

Properties

Computed

Calculated molecular descriptors used in drug design and computational chemistry.

Exact Mass
305.0641 Da
XLogP
4.90
TPSA
54.4 Ų
H-Bond Donors
1
H-Bond Acceptors
2
Complexity
307
Formal Charge
0

Safety information

No safety data available for this chemical.

Synonyms (2)

  • AKOS008337811
  • 2-(BENZYLTHIO)-3'-CHLORO-4'-METHYLACETANILIDE

Frequently asked questions

What is the IUPAC name of 2-(Benzylthio)-3'-chloro-4'-methylacetanilide?

The IUPAC name of 2-(Benzylthio)-3'-chloro-4'-methylacetanilide is 2-benzylsulfanyl-N-(3-chloro-4-methylphenyl)acetamide.

What is the molecular formula of 2-(Benzylthio)-3'-chloro-4'-methylacetanilide?

2-(Benzylthio)-3'-chloro-4'-methylacetanilide has the molecular formula C16H16ClNOS and a molecular weight of 305.8 g/mol.

What is the SMILES notation for 2-(Benzylthio)-3'-chloro-4'-methylacetanilide?

The SMILES notation for 2-(Benzylthio)-3'-chloro-4'-methylacetanilide is CC1=C(C=C(C=C1)NC(=O)CSCC2=CC=CC=C2)Cl.

What are other names for 2-(Benzylthio)-3'-chloro-4'-methylacetanilide?

2-(Benzylthio)-3'-chloro-4'-methylacetanilide is also known as 2-(BENZYLTHIO)-3'-CHLORO-4'-METHYLACETANILIDE, AKOS008337811.

Data sourced from PubChem CID 853999. Last updated .

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