methyl 5-cyano-4-(2-ethoxyphenyl)-2-methyl-6-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 5-cyano-4-(2-ethoxyphenyl)-2-methyl-6-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 5-cyano-4-(2-ethoxyphenyl)-2-methyl-6-[2-(4-nitroanilino)-2-oxo-ethyl]sulfanyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-4-(2-ethoxyphenyl)-2-methyl-6-[[2-(4-nitroanilino)-2-oxoethyl]thio]-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-cyano-4-(2-ethoxyphenyl)-2-methyl-6-[2-(4-nitroanilino)-2-oxoethyl]sulfanyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-keto-2-(4-nitroanilino)ethyl]thio]-2-methyl-4-o-phenetyl-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C25H24N4O6S MolecularWeight: 508.54626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2C(=C(NC(=C2C(=O)OC)C)SCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

CCOC1=CC=CC=C1C2C(=C(NC(=C2C(=O)OC)C)SCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C25H24N4O6S/c1-4-35-20-8-6-5-7-18(20)23-19(13-26)24(27-15(2)22(23)25(31)34-3)36-14-21(30)28-16-9-11-17(12-10-16)29(32)33/h5-12,23,27H,4,14H2,1-3H3,(H,28,30)