ethyl 5-cyano-2,6-dimethyl-4-(4-oxidanylidene-2-phenyl-thiochromen-8-yl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2,6-dimethyl-4-(4-oxidanylidene-2-phenyl-thiochromen-8-yl)-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2,6-dimethyl-4-(4-oxo-2-phenyl-thiochromen-8-yl)-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-2,6-dimethyl-4-(4-oxo-2-phenyl-1-benzothiopyran-8-yl)-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2,6-dimethyl-4-(4-oxo-2-phenylthiochromen-8-yl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-4-(4-keto-2-phenyl-thiochromen-8-yl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C26H22N2O3S MolecularWeight: 442.52948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC3=C2SC(=CC3=O)C4=CC=CC=C4)C#N)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC3=C2SC(=CC3=O)C4=CC=CC=C4)C#N)C)C

InChI

InChI=1S/C26H22N2O3S/c1-4-31-26(30)23-16(3)28-15(2)20(14-27)24(23)19-12-8-11-18-21(29)13-22(32-25(18)19)17-9-6-5-7-10-17/h5-13,24,28H,4H2,1-3H3