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

Systemtic Name: propan-2-yl 3-[[4-oxidanylidene-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-3-yl]methyl]benzoate Openeye Name: isopropyl 3-[[5-(4-isopropylphenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]methyl]benzoate CAS Name: 3-[[4-oxo-5-(4-propan-2-ylphenyl)-3-thieno[2,3-d]pyrimidinyl]methyl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[4-oxo-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-3-yl]methyl]benzoate Traditional Name: 3-[(4-keto-5-p-cumenyl-thieno[2,3-d]pyrimidin-3-yl)methyl]benzoic acid isopropyl ester Formula: C26H26N2O3S MolecularWeight: 446.56124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC4=CC=CC(=C4)C(=O)OC(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC4=CC=CC(=C4)C(=O)OC(C)C

InChI

InChI=1S/C26H26N2O3S/c1-16(2)19-8-10-20(11-9-19)22-14-32-24-23(22)25(29)28(15-27-24)13-18-6-5-7-21(12-18)26(30)31-17(3)4/h5-12,14-17H,13H2,1-4H3