methyl 4-oxidanylidene-2-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)carbonyloxymethyl]-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 4-oxidanylidene-2-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)carbonyloxymethyl]-1H-quinazoline-7-carboxylate Openeye Name: methyl 4-oxo-2-[[1-phenyl-3-(2-thienyl)pyrazole-4-carbonyl]oxymethyl]-1H-quinazoline-7-carboxylate CAS Name: 4-oxo-2-[[oxo-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methoxy]methyl]-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 4-oxo-2-[(1-phenyl-3-thiophen-2-ylpyrazole-4-carbonyl)oxymethyl]-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-[[1-phenyl-3-(2-thienyl)pyrazole-4-carbonyl]oxymethyl]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C25H18N4O5S MolecularWeight: 486.49922

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)C3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)C3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C25H18N4O5S/c1-33-24(31)15-9-10-17-19(12-15)26-21(27-23(17)30)14-34-25(32)18-13-29(16-6-3-2-4-7-16)28-22(18)20-8-5-11-35-20/h2-13H,14H2,1H3,(H,26,27,30)