3-(4-chlorophenyl)sulfanyl-N-(1-oxidanylbutan-2-yl)propanamide

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-N-(1-oxidanylbutan-2-yl)propanamide Openeye Name: 3-(4-chlorophenyl)sulfanyl-N-[1-(hydroxymethyl)propyl]propanamide CAS Name: 3-[(4-chlorophenyl)thio]-N-(1-hydroxybutan-2-yl)propanamide IUPAC Name: 3-(4-chlorophenyl)sulfanyl-N-(1-hydroxybutan-2-yl)propanamide Traditional Name: 3-[(4-chlorophenyl)thio]-N-(1-methylolpropyl)propionamide Formula: C13H18ClNO2S MolecularWeight: 287.80552

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC(=O)CCSC1=CC=C(C=C1)Cl

Isomeric SMILES

CCC(CO)NC(=O)CCSC1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H18ClNO2S/c1-2-11(9-16)15-13(17)7-8-18-12-5-3-10(14)4-6-12/h3-6,11,16H,2,7-9H2,1H3,(H,15,17)