N-[1-(3,4-dimethylphenyl)ethyl]-2-[3-(4-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[1-(3,4-dimethylphenyl)ethyl]-2-[3-(4-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[1-(3,4-dimethylphenyl)ethyl]-2-[3-(4-methyl-2-pyridyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[1-(3,4-dimethylphenyl)ethyl]-2-[[3-(4-methyl-2-pyridinyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[1-(3,4-dimethylphenyl)ethyl]-2-[3-(4-methylpyridin-2-yl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-[1-(3,4-dimethylphenyl)ethyl]-2-[[4-keto-3-(4-methyl-2-pyridyl)quinazolin-2-yl]thio]acetamide Formula: C26H26N4O2S MolecularWeight: 458.57524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(C)C4=CC(=C(C=C4)C)C

Isomeric SMILES

CC1=CC(=NC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(C)C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C26H26N4O2S/c1-16-11-12-27-23(13-16)30-25(32)21-7-5-6-8-22(21)29-26(30)33-15-24(31)28-19(4)20-10-9-17(2)18(3)14-20/h5-14,19H,15H2,1-4H3,(H,28,31)