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

Systemtic Name: methyl 4-[(5-naphthalen-2-yl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)methyl]benzoate Openeye Name: methyl 4-[[5-(2-naphthyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]methyl]benzoate CAS Name: 4-[[5-(2-naphthalenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(5-naphthalen-2-yl-4-oxothieno[2,3-d]pyrimidin-3-yl)methyl]benzoate Traditional Name: 4-[[4-keto-5-(2-naphthyl)thieno[2,3-d]pyrimidin-3-yl]methyl]benzoic acid methyl ester Formula: C25H18N2O3S MolecularWeight: 426.48702

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)C(=CS3)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)C(=CS3)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H18N2O3S/c1-30-25(29)18-8-6-16(7-9-18)13-27-15-26-23-22(24(27)28)21(14-31-23)20-11-10-17-4-2-3-5-19(17)12-20/h2-12,14-15H,13H2,1H3