3-methoxy-N-[4-[2-[(2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]benzamide

Systemtic Name: 3-methoxy-N-[4-[2-[(2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]benzamide Openeye Name: 3-methoxy-N-[4-[2-(2-methyl-4-nitro-anilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]benzamide CAS Name: 3-methoxy-N-[4-[[2-(2-methyl-4-nitroanilino)-2-oxo-1-phenylethyl]thio]phenyl]benzamide IUPAC Name: 3-methoxy-N-[4-[2-(2-methyl-4-nitroanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]benzamide Traditional Name: N-[4-[[2-keto-2-(2-methyl-4-nitro-anilino)-1-phenyl-ethyl]thio]phenyl]-3-methoxy-benzamide Formula: C29H25N3O5S MolecularWeight: 527.5909

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C29H25N3O5S/c1-19-17-23(32(35)36)13-16-26(19)31-29(34)27(20-7-4-3-5-8-20)38-25-14-11-22(12-15-25)30-28(33)21-9-6-10-24(18-21)37-2/h3-18,27H,1-2H3,(H,30,33)(H,31,34)