3-methyl-2-[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-butanamide

Systemtic Name: 3-methyl-2-[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-butanamide Openeye Name: 3-methyl-2-[2-(2-nitroanilino)-2-oxo-ethyl]sulfanyl-N-phenyl-butanamide CAS Name: 3-methyl-2-[[2-(2-nitroanilino)-2-oxoethyl]thio]-N-phenylbutanamide IUPAC Name: 3-methyl-2-[2-(2-nitroanilino)-2-oxoethyl]sulfanyl-N-phenylbutanamide Traditional Name: 2-[[2-keto-2-(2-nitroanilino)ethyl]thio]-3-methyl-N-phenyl-butyramide Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=CC=C1)SCC(=O)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=CC=C1)SCC(=O)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O4S/c1-13(2)18(19(24)20-14-8-4-3-5-9-14)27-12-17(23)21-15-10-6-7-11-16(15)22(25)26/h3-11,13,18H,12H2,1-2H3,(H,20,24)(H,21,23)