methyl (4S)-5-cyano-2-methyl-6-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl (4S)-5-cyano-2-methyl-6-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl (4S)-5-cyano-2-methyl-6-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]sulfanyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxylate CAS Name: (4S)-5-cyano-2-methyl-6-[[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]thio]-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl (4S)-5-cyano-2-methyl-6-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]sulfanyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate Traditional Name: (4S)-5-cyano-6-[[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]thio]-2-methyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C19H18N4O4S2 MolecularWeight: 430.50062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)OC)C3=CC=CS3)C#N

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CSC2=C([C@H](C(=C(N2)C)C(=O)OC)C3=CC=CS3)C#N

InChI

InChI=1S/C19H18N4O4S2/c1-10-7-14(23-27-10)22-15(24)9-29-18-12(8-20)17(13-5-4-6-28-13)16(11(2)21-18)19(25)26-3/h4-7,17,21H,9H2,1-3H3,(H,22,23,24)/t17-/m0/s1