(4S)-6-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-5-cyano-N-(2-methoxyphenyl)-2-methyl-4-(5-methylfuran-2-yl)-1,4-dihydropyridine-3-carboxamide

Systemtic Name: (4S)-6-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-5-cyano-N-(2-methoxyphenyl)-2-methyl-4-(5-methylfuran-2-yl)-1,4-dihydropyridine-3-carboxamide Openeye Name: (4S)-6-(2-amino-2-oxo-ethyl)sulfanyl-5-cyano-N-(2-methoxyphenyl)-2-methyl-4-(5-methyl-2-furyl)-1,4-dihydropyridine-3-carboxamide CAS Name: (4S)-6-[(2-amino-2-oxoethyl)thio]-5-cyano-N-(2-methoxyphenyl)-2-methyl-4-(5-methyl-2-furanyl)-1,4-dihydropyridine-3-carboxamide IUPAC Name: (4S)-6-(2-amino-2-oxoethyl)sulfanyl-5-cyano-N-(2-methoxyphenyl)-2-methyl-4-(5-methylfuran-2-yl)-1,4-dihydropyridine-3-carboxamide Traditional Name: (4S)-6-[(2-amino-2-keto-ethyl)thio]-5-cyano-N-(2-methoxyphenyl)-2-methyl-4-(5-methyl-2-furyl)-1,4-dihydropyridine-3-carboxamide Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2C(=C(NC(=C2C(=O)NC3=CC=CC=C3OC)C)SCC(=O)N)C#N

Isomeric SMILES

CC1=CC=C(O1)[C@@H]2C(=C(NC(=C2C(=O)NC3=CC=CC=C3OC)C)SCC(=O)N)C#N

InChI

InChI=1S/C22H22N4O4S/c1-12-8-9-17(30-12)20-14(10-23)22(31-11-18(24)27)25-13(2)19(20)21(28)26-15-6-4-5-7-16(15)29-3/h4-9,20,25H,11H2,1-3H3,(H2,24,27)(H,26,28)/t20-/m0/s1