methyl 7-cyclopropyl-4-oxidanylidene-1-(1-phenylethyl)-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: methyl 7-cyclopropyl-4-oxidanylidene-1-(1-phenylethyl)-2-sulfanylidene-pyrido[2,3-d]pyrimidine-5-carboxylate Openeye Name: methyl 7-cyclopropyl-4-oxo-1-(1-phenylethyl)-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylate CAS Name: 7-cyclopropyl-4-oxo-1-(1-phenylethyl)-2-sulfanylidene-5-pyrido[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 7-cyclopropyl-4-oxo-1-(1-phenylethyl)-2-sulfanylidenepyrido[2,3-d]pyrimidine-5-carboxylate Traditional Name: 7-cyclopropyl-4-keto-1-(1-phenylethyl)-2-thioxo-pyrido[2,3-d]pyrimidine-5-carboxylic acid methyl ester Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C3=C(C(=CC(=N3)C4CC4)C(=O)OC)C(=O)NC2=S

Isomeric SMILES

CC(C1=CC=CC=C1)N2C3=C(C(=CC(=N3)C4CC4)C(=O)OC)C(=O)NC2=S

InChI

InChI=1S/C20H19N3O3S/c1-11(12-6-4-3-5-7-12)23-17-16(18(24)22-20(23)27)14(19(25)26-2)10-15(21-17)13-8-9-13/h3-7,10-11,13H,8-9H2,1-2H3,(H,22,24,27)