5-cyano-2-methyl-N-phenyl-4-pyridin-4-yl-6-sulfanyl-1,4-dihydropyridine-3-carboxamide; 4-methylmorpholine

Systemtic Name: 5-cyano-2-methyl-N-phenyl-4-pyridin-4-yl-6-sulfanyl-1,4-dihydropyridine-3-carboxamide; 4-methylmorpholine Openeye Name: 5-cyano-2-methyl-N-phenyl-4-(4-pyridyl)-6-sulfanyl-1,4-dihydropyridine-3-carboxamide; 4-methylmorpholine CAS Name: 5-cyano-6-mercapto-2-methyl-N-phenyl-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxamide; 4-methylmorpholine IUPAC Name: 5-cyano-2-methyl-N-phenyl-4-pyridin-4-yl-6-sulfanyl-1,4-dihydropyridine-3-carboxamide; 4-methylmorpholine Traditional Name: 5-cyano-6-mercapto-2-methyl-N-phenyl-4-(4-pyridyl)-1,4-dihydropyridine-3-carboxamide; 4-methylmorpholine Formula: C24H27N5O2S MolecularWeight: 449.56848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)S)C#N)C2=CC=NC=C2)C(=O)NC3=CC=CC=C3.CN1CCOCC1

Isomeric SMILES

CC1=C(C(C(=C(N1)S)C#N)C2=CC=NC=C2)C(=O)NC3=CC=CC=C3.CN1CCOCC1

InChI

InChI=1S/C19H16N4OS.C5H11NO/c1-12-16(18(24)23-14-5-3-2-4-6-14)17(13-7-9-21-10-8-13)15(11-20)19(25)22-12;1-6-2-4-7-5-3-6/h2-10,17,22,25H,1H3,(H,23,24);2-5H2,1H3