N-(5-chloranyl-2-oxidanyl-phenyl)-3-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-(5-chloranyl-2-oxidanyl-phenyl)-3-(phenylmethylsulfanyl)propanamide Openeye Name: 3-benzylsulfanyl-N-(5-chloro-2-hydroxy-phenyl)propanamide CAS Name: N-(5-chloro-2-hydroxyphenyl)-3-(phenylmethylthio)propanamide IUPAC Name: 3-benzylsulfanyl-N-(5-chloro-2-hydroxyphenyl)propanamide Traditional Name: 3-(benzylthio)-N-(5-chloro-2-hydroxy-phenyl)propionamide Formula: C16H16ClNO2S MolecularWeight: 321.82174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCC(=O)NC2=C(C=CC(=C2)Cl)O

Isomeric SMILES

C1=CC=C(C=C1)CSCCC(=O)NC2=C(C=CC(=C2)Cl)O

InChI

InChI=1S/C16H16ClNO2S/c17-13-6-7-15(19)14(10-13)18-16(20)8-9-21-11-12-4-2-1-3-5-12/h1-7,10,19H,8-9,11H2,(H,18,20)