2-(3-aminophenyl)sulfanyl-N-(2-methyl-5-nitro-phenyl)-2-phenyl-ethanamide

Systemtic Name: 2-(3-aminophenyl)sulfanyl-N-(2-methyl-5-nitro-phenyl)-2-phenyl-ethanamide Openeye Name: 2-(3-aminophenyl)sulfanyl-N-(2-methyl-5-nitro-phenyl)-2-phenyl-acetamide CAS Name: 2-[(3-aminophenyl)thio]-N-(2-methyl-5-nitrophenyl)-2-phenylacetamide IUPAC Name: 2-(3-aminophenyl)sulfanyl-N-(2-methyl-5-nitrophenyl)-2-phenylacetamide Traditional Name: 2-[(3-aminophenyl)thio]-N-(2-methyl-5-nitro-phenyl)-2-phenyl-acetamide Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)N

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)N

InChI

InChI=1S/C21H19N3O3S/c1-14-10-11-17(24(26)27)13-19(14)23-21(25)20(15-6-3-2-4-7-15)28-18-9-5-8-16(22)12-18/h2-13,20H,22H2,1H3,(H,23,25)