2-(3-aminophenyl)sulfanyl-N-(1,3-benzodioxol-5-yl)butanamide

Systemtic Name: 2-(3-aminophenyl)sulfanyl-N-(1,3-benzodioxol-5-yl)butanamide Openeye Name: 2-(3-aminophenyl)sulfanyl-N-(1,3-benzodioxol-5-yl)butanamide CAS Name: 2-[(3-aminophenyl)thio]-N-(1,3-benzodioxol-5-yl)butanamide IUPAC Name: 2-(3-aminophenyl)sulfanyl-N-(1,3-benzodioxol-5-yl)butanamide Traditional Name: 2-[(3-aminophenyl)thio]-N-(1,3-benzodioxol-5-yl)butyramide Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=CC=CC(=C3)N

Isomeric SMILES

CCC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=CC=CC(=C3)N

InChI

InChI=1S/C17H18N2O3S/c1-2-16(23-13-5-3-4-11(18)8-13)17(20)19-12-6-7-14-15(9-12)22-10-21-14/h3-9,16H,2,10,18H2,1H3,(H,19,20)