N-[3-[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]cyclopropanecarboxamide Openeye Name: N-[3-[2-(2-methyl-5-nitro-anilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]cyclopropanecarboxamide CAS Name: N-[3-[[2-(2-methyl-5-nitroanilino)-2-oxo-1-phenylethyl]thio]phenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[2-(2-methyl-5-nitroanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]cyclopropanecarboxamide Traditional Name: N-[3-[[2-keto-2-(2-methyl-5-nitro-anilino)-1-phenyl-ethyl]thio]phenyl]cyclopropanecarboxamide Formula: C25H23N3O4S MolecularWeight: 461.53282

Click to see the large picture

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)NC(=O)C4CC4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=O)C4CC4

InChI

InChI=1S/C25H23N3O4S/c1-16-10-13-20(28(31)32)15-22(16)27-25(30)23(17-6-3-2-4-7-17)33-21-9-5-8-19(14-21)26-24(29)18-11-12-18/h2-10,13-15,18,23H,11-12H2,1H3,(H,26,29)(H,27,30)