(E)-N-[4-[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[4-[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[4-[2-(2-methyl-5-nitro-anilino)-2-oxo-ethyl]sulfanylphenyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[4-[[2-(2-methyl-5-nitroanilino)-2-oxoethyl]thio]phenyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[4-[2-(2-methyl-5-nitroanilino)-2-oxoethyl]sulfanylphenyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[4-[[2-keto-2-(2-methyl-5-nitro-anilino)ethyl]thio]phenyl]-3-phenyl-acrylamide Formula: C24H21N3O4S MolecularWeight: 447.50624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=CC=C(C=C2)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=CC=C(C=C2)NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C24H21N3O4S/c1-17-7-11-20(27(30)31)15-22(17)26-24(29)16-32-21-12-9-19(10-13-21)25-23(28)14-8-18-5-3-2-4-6-18/h2-15H,16H2,1H3,(H,25,28)(H,26,29)/b14-8+