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

Systemtic Name: 3-(2,3-dimethylphenyl)-4-oxidanylidene-N-[phenyl(pyridin-2-yl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-(2,3-dimethylphenyl)-4-oxo-N-[phenyl(2-pyridyl)methyl]-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-(2,3-dimethylphenyl)-4-oxo-N-[phenyl(2-pyridinyl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-(2,3-dimethylphenyl)-4-oxo-N-[phenyl(pyridin-2-yl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-(2,3-dimethylphenyl)-4-keto-N-[phenyl(2-pyridyl)methyl]-2-thioxo-1H-quinazoline-7-carboxamide Formula: C29H24N4O2S MolecularWeight: 492.59146

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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)NC(C4=CC=CC=C4)C5=CC=CC=N5)NC2=S)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NC(C4=CC=CC=C4)C5=CC=CC=N5)NC2=S)C

InChI

InChI=1S/C29H24N4O2S/c1-18-9-8-13-25(19(18)2)33-28(35)22-15-14-21(17-24(22)31-29(33)36)27(34)32-26(20-10-4-3-5-11-20)23-12-6-7-16-30-23/h3-17,26H,1-2H3,(H,31,36)(H,32,34)