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

Systemtic Name: prop-2-enyl 6-[2-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-5-cyano-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate Openeye Name: allyl 6-[2-(4-chloro-2,5-dimethoxy-anilino)-2-oxo-ethyl]sulfanyl-5-cyano-2-methyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 6-[[2-(4-chloro-2,5-dimethoxyanilino)-2-oxoethyl]thio]-5-cyano-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 6-[2-(4-chloro-2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl-5-cyano-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate Traditional Name: 6-[[2-(4-chloro-2,5-dimethoxy-anilino)-2-keto-ethyl]thio]-5-cyano-2-methyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxylic acid allyl ester Formula: C25H24ClN3O5S2 MolecularWeight: 546.05816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC(=O)NC2=CC(=C(C=C2OC)Cl)OC)C#N)C3=CC=CS3)C(=O)OCC=C

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC(=O)NC2=CC(=C(C=C2OC)Cl)OC)C#N)C3=CC=CS3)C(=O)OCC=C

InChI

InChI=1S/C25H24ClN3O5S2/c1-5-8-34-25(31)22-14(2)28-24(15(12-27)23(22)20-7-6-9-35-20)36-13-21(30)29-17-11-18(32-3)16(26)10-19(17)33-4/h5-7,9-11,23,28H,1,8,13H2,2-4H3,(H,29,30)