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

Systemtic Name: 5-cyano-2-methyl-N,4-diphenyl-6-sulfanyl-1,4-dihydropyridine-3-carboxamide; 4-methylmorpholine Openeye Name: 5-cyano-2-methyl-N,4-diphenyl-6-sulfanyl-1,4-dihydropyridine-3-carboxamide; 4-methylmorpholine CAS Name: 5-cyano-6-mercapto-2-methyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide; 4-methylmorpholine IUPAC Name: 5-cyano-2-methyl-N,4-diphenyl-6-sulfanyl-1,4-dihydropyridine-3-carboxamide; 4-methylmorpholine Traditional Name: 5-cyano-6-mercapto-2-methyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide; 4-methylmorpholine Formula: C25H28N4O2S MolecularWeight: 448.58042

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N3OS.C5H11NO/c1-13-17(19(24)23-15-10-6-3-7-11-15)18(14-8-4-2-5-9-14)16(12-21)20(25)22-13;1-6-2-4-7-5-3-6/h2-11,18,22,25H,1H3,(H,23,24);2-5H2,1H3