ethyl 2-(2,5-diphenyl-5,6-dihydrothieno[2,3-d]pyrimidin-4-yl)-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-(2,5-diphenyl-5,6-dihydrothieno[2,3-d]pyrimidin-4-yl)-3-oxidanylidene-butanoate Openeye Name: ethyl 2-(2,5-diphenyl-5,6-dihydrothieno[2,3-d]pyrimidin-4-yl)-3-oxo-butanoate CAS Name: 2-(2,5-diphenyl-5,6-dihydrothieno[2,3-d]pyrimidin-4-yl)-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-(2,5-diphenyl-5,6-dihydrothieno[2,3-d]pyrimidin-4-yl)-3-oxobutanoate Traditional Name: 2-(2,5-diphenyl-5,6-dihydrothieno[2,3-d]pyrimidin-4-yl)-3-keto-butyric acid ethyl ester Formula: C24H22N2O3S MolecularWeight: 418.50808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C2C(CSC2=NC(=N1)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C

Isomeric SMILES

CCOC(=O)C(C1=C2C(CSC2=NC(=N1)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C

InChI

InChI=1S/C24H22N2O3S/c1-3-29-24(28)19(15(2)27)21-20-18(16-10-6-4-7-11-16)14-30-23(20)26-22(25-21)17-12-8-5-9-13-17/h4-13,18-19H,3,14H2,1-2H3