methyl 4-(4-oxidanylidene-7-phenyl-2-sulfanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidin-5-yl)benzoate

Systemtic Name: methyl 4-(4-oxidanylidene-7-phenyl-2-sulfanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidin-5-yl)benzoate Openeye Name: methyl 4-(4-oxo-7-phenyl-2-thioxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidin-5-yl)benzoate CAS Name: 4-(4-oxo-7-phenyl-2-sulfanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidin-5-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-oxo-7-phenyl-2-sulfanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidin-5-yl)benzoate Traditional Name: 4-(4-keto-7-phenyl-2-thioxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidin-5-yl)benzoic acid methyl ester Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2C=C(NC3=C2C(=O)NC(=S)N3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2C=C(NC3=C2C(=O)NC(=S)N3)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O3S/c1-27-20(26)14-9-7-12(8-10-14)15-11-16(13-5-3-2-4-6-13)22-18-17(15)19(25)24-21(28)23-18/h2-11,15H,1H3,(H3,22,23,24,25,28)