prop-2-enyl 5-cyano-2-methyl-6-oxidanyl-4-pyridin-3-yl-1,4-dihydropyridine-3-carboxylate; thiomorpholine

Systemtic Name: prop-2-enyl 5-cyano-2-methyl-6-oxidanyl-4-pyridin-3-yl-1,4-dihydropyridine-3-carboxylate; thiomorpholine Openeye Name: allyl 5-cyano-6-hydroxy-2-methyl-4-(3-pyridyl)-1,4-dihydropyridine-3-carboxylate; thiomorpholine CAS Name: 5-cyano-6-hydroxy-2-methyl-4-(3-pyridinyl)-1,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester; thiomorpholine IUPAC Name: prop-2-enyl 5-cyano-6-hydroxy-2-methyl-4-pyridin-3-yl-1,4-dihydropyridine-3-carboxylate; thiomorpholine Traditional Name: 5-cyano-6-hydroxy-2-methyl-4-(3-pyridyl)-1,4-dihydropyridine-3-carboxylic acid allyl ester; thiomorpholine Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)O)C#N)C2=CN=CC=C2)C(=O)OCC=C.C1CSCCN1

Isomeric SMILES

CC1=C(C(C(=C(N1)O)C#N)C2=CN=CC=C2)C(=O)OCC=C.C1CSCCN1

InChI

InChI=1S/C16H15N3O3.C4H9NS/c1-3-7-22-16(21)13-10(2)19-15(20)12(8-17)14(13)11-5-4-6-18-9-11;1-3-6-4-2-5-1/h3-6,9,14,19-20H,1,7H2,2H3;5H,1-4H2