propyl 4-[[5-(4-ethylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]methyl]benzoate

Systemtic Name: propyl 4-[[5-(4-ethylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]methyl]benzoate Openeye Name: propyl 4-[[5-(4-ethylphenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]methyl]benzoate CAS Name: 4-[[5-(4-ethylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]methyl]benzoic acid propyl ester IUPAC Name: propyl 4-[[5-(4-ethylphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]methyl]benzoate Traditional Name: 4-[[5-(4-ethylphenyl)-4-keto-thieno[2,3-d]pyrimidin-3-yl]methyl]benzoic acid propyl ester Formula: C25H24N2O3S MolecularWeight: 432.53466

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)CC

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)CC

InChI

InChI=1S/C25H24N2O3S/c1-3-13-30-25(29)20-11-7-18(8-12-20)14-27-16-26-23-22(24(27)28)21(15-31-23)19-9-5-17(4-2)6-10-19/h5-12,15-16H,3-4,13-14H2,1-2H3