3-(2,3-dimethylphenyl)-N-[(2-methoxypyridin-3-yl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-(2,3-dimethylphenyl)-N-[(2-methoxypyridin-3-yl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-(2,3-dimethylphenyl)-N-[(2-methoxy-3-pyridyl)methyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-(2,3-dimethylphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-(2,3-dimethylphenyl)-N-[(2-methoxypyridin-3-yl)methyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-(2,3-dimethylphenyl)-4-keto-N-[(2-methoxy-3-pyridyl)methyl]-2-thioxo-1H-quinazoline-7-carboxamide Formula: C24H22N4O3S MolecularWeight: 446.52148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NCC4=C(N=CC=C4)OC)NC2=S)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NCC4=C(N=CC=C4)OC)NC2=S)C

InChI

InChI=1S/C24H22N4O3S/c1-14-6-4-8-20(15(14)2)28-23(30)18-10-9-16(12-19(18)27-24(28)32)21(29)26-13-17-7-5-11-25-22(17)31-3/h4-12H,13H2,1-3H3,(H,26,29)(H,27,32)