3-(2,3-dimethylphenyl)-4-oxidanylidene-N-(2-quinolin-8-ylethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-(2,3-dimethylphenyl)-4-oxidanylidene-N-(2-quinolin-8-ylethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-(2,3-dimethylphenyl)-4-oxo-N-[2-(8-quinolyl)ethyl]-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-(2,3-dimethylphenyl)-4-oxo-N-[2-(8-quinolinyl)ethyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-(2,3-dimethylphenyl)-4-oxo-N-(2-quinolin-8-ylethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-(2,3-dimethylphenyl)-4-keto-N-[2-(8-quinolyl)ethyl]-2-thioxo-1H-quinazoline-7-carboxamide Formula: C28H24N4O2S MolecularWeight: 480.58076

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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)NCCC4=CC=CC5=C4N=CC=C5)NC2=S)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NCCC4=CC=CC5=C4N=CC=C5)NC2=S)C

InChI

InChI=1S/C28H24N4O2S/c1-17-6-3-10-24(18(17)2)32-27(34)22-12-11-21(16-23(22)31-28(32)35)26(33)30-15-13-20-8-4-7-19-9-5-14-29-25(19)20/h3-12,14,16H,13,15H2,1-2H3,(H,30,33)(H,31,35)