prop-2-enyl 5-cyano-6-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: prop-2-enyl 5-cyano-6-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate Openeye Name: allyl 5-cyano-6-[2-(2-ethylanilino)-2-oxo-ethyl]sulfanyl-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-6-[[2-(2-ethylanilino)-2-oxoethyl]thio]-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 5-cyano-6-[2-(2-ethylanilino)-2-oxoethyl]sulfanyl-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-(2-ethylanilino)-2-keto-ethyl]thio]-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylic acid allyl ester Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)OCC=C)C3=CC=CC=C3)C#N

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)OCC=C)C3=CC=CC=C3)C#N

InChI

InChI=1S/C27H27N3O3S/c1-4-15-33-27(32)24-18(3)29-26(21(16-28)25(24)20-12-7-6-8-13-20)34-17-23(31)30-22-14-10-9-11-19(22)5-2/h4,6-14,25,29H,1,5,15,17H2,2-3H3,(H,30,31)