2-[3-(2-acetamidoethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[3-(2-acetamidoethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-methylphenyl)ethanamide Openeye Name: 2-[3-(2-acetamidoethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(p-tolyl)acetamide CAS Name: 2-[[3-(2-acetamidoethyl)-4-oxo-2-quinazolinyl]thio]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[3-(2-acetamidoethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(4-methylphenyl)acetamide Traditional Name: 2-[[3-(2-acetamidoethyl)-4-keto-quinazolin-2-yl]thio]-N-(p-tolyl)acetamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCNC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCNC(=O)C

InChI

InChI=1S/C21H22N4O3S/c1-14-7-9-16(10-8-14)23-19(27)13-29-21-24-18-6-4-3-5-17(18)20(28)25(21)12-11-22-15(2)26/h3-10H,11-13H2,1-2H3,(H,22,26)(H,23,27)