dimethyl 2-methyl-4-(5-methyl-6-sulfanylidene-cyclohexa-1,3-dien-1-yl)-6-(phenylselanylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 2-methyl-4-(5-methyl-6-sulfanylidene-cyclohexa-1,3-dien-1-yl)-6-(phenylselanylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl 2-methyl-4-(5-methyl-6-thioxo-cyclohexa-1,3-dien-1-yl)-6-(phenylselanylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-methyl-4-(5-methyl-6-sulfanylidene-1-cyclohexa-1,3-dienyl)-6-[(phenylseleno)methyl]-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-methyl-4-(5-methyl-6-sulfanylidenecyclohexa-1,3-dien-1-yl)-6-(phenylselanylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-methyl-4-(5-methyl-6-thioxo-cyclohexa-1,3-dien-1-yl)-6-[(phenylseleno)methyl]-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Formula: C24H25NO4SSe MolecularWeight: 502.4846

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC=C(C1=S)C2C(=C(NC(=C2C(=O)OC)C[Se]C3=CC=CC=C3)C)C(=O)OC

Isomeric SMILES

CC1C=CC=C(C1=S)C2C(=C(NC(=C2C(=O)OC)C[Se]C3=CC=CC=C3)C)C(=O)OC

InChI

InChI=1S/C24H25NO4SSe/c1-14-9-8-12-17(22(14)30)20-19(23(26)28-3)15(2)25-18(21(20)24(27)29-4)13-31-16-10-6-5-7-11-16/h5-12,14,20,25H,13H2,1-4H3