N-(3-acetamidophenyl)-2-[7-chloranyl-3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-acetamidophenyl)-2-[7-chloranyl-3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(3-acetamidophenyl)-2-[7-chloro-3-(m-tolyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(3-acetamidophenyl)-2-[[7-chloro-3-(3-methylphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(3-acetamidophenyl)-2-[7-chloro-3-(3-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-(3-acetamidophenyl)-2-[[7-chloro-4-keto-3-(m-tolyl)quinazolin-2-yl]thio]acetamide Formula: C25H21ClN4O3S MolecularWeight: 492.97724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC4=CC=CC(=C4)NC(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC4=CC=CC(=C4)NC(=O)C

InChI

InChI=1S/C25H21ClN4O3S/c1-15-5-3-8-20(11-15)30-24(33)21-10-9-17(26)12-22(21)29-25(30)34-14-23(32)28-19-7-4-6-18(13-19)27-16(2)31/h3-13H,14H2,1-2H3,(H,27,31)(H,28,32)