methyl 8-butyl-4-methyl-5-oxidanylidene-3-phenyl-2-sulfanylidene-pyrido[2,3-d]pyrimidine-7-carboxylate

Systemtic Name: methyl 8-butyl-4-methyl-5-oxidanylidene-3-phenyl-2-sulfanylidene-pyrido[2,3-d]pyrimidine-7-carboxylate Openeye Name: methyl 8-butyl-4-methyl-5-oxo-3-phenyl-2-thioxo-pyrido[2,3-d]pyrimidine-7-carboxylate CAS Name: 8-butyl-4-methyl-5-oxo-3-phenyl-2-sulfanylidene-7-pyrido[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 8-butyl-4-methyl-5-oxo-3-phenyl-2-sulfanylidenepyrido[2,3-d]pyrimidine-7-carboxylate Traditional Name: 8-butyl-5-keto-4-methyl-3-phenyl-2-thioxo-pyrido[2,3-d]pyrimidine-7-carboxylic acid methyl ester Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CC(=O)C2=C(N(C(=S)N=C21)C3=CC=CC=C3)C)C(=O)OC

Isomeric SMILES

CCCCN1C(=CC(=O)C2=C(N(C(=S)N=C21)C3=CC=CC=C3)C)C(=O)OC

InChI

InChI=1S/C20H21N3O3S/c1-4-5-11-22-15(19(25)26-3)12-16(24)17-13(2)23(20(27)21-18(17)22)14-9-7-6-8-10-14/h6-10,12H,4-5,11H2,1-3H3