2-(3-acetamidophenyl)sulfanyl-N-(2-methyl-5-nitro-phenyl)butanamide

Systemtic Name: 2-(3-acetamidophenyl)sulfanyl-N-(2-methyl-5-nitro-phenyl)butanamide Openeye Name: 2-(3-acetamidophenyl)sulfanyl-N-(2-methyl-5-nitro-phenyl)butanamide CAS Name: 2-[(3-acetamidophenyl)thio]-N-(2-methyl-5-nitrophenyl)butanamide IUPAC Name: 2-(3-acetamidophenyl)sulfanyl-N-(2-methyl-5-nitrophenyl)butanamide Traditional Name: 2-[(3-acetamidophenyl)thio]-N-(2-methyl-5-nitro-phenyl)butyramide Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])C)SC2=CC=CC(=C2)NC(=O)C

Isomeric SMILES

CCC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])C)SC2=CC=CC(=C2)NC(=O)C

InChI

InChI=1S/C19H21N3O4S/c1-4-18(27-16-7-5-6-14(10-16)20-13(3)23)19(24)21-17-11-15(22(25)26)9-8-12(17)2/h5-11,18H,4H2,1-3H3,(H,20,23)(H,21,24)