2-[3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[4-(cyanomethyl)phenyl]ethanamide

Systemtic Name: 2-[3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[4-(cyanomethyl)phenyl]ethanamide Openeye Name: 2-[3-(2-chlorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[4-(cyanomethyl)phenyl]acetamide CAS Name: 2-[[3-(2-chlorophenyl)-4-oxo-2-quinazolinyl]thio]-N-[4-(cyanomethyl)phenyl]acetamide IUPAC Name: 2-[3-(2-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[4-(cyanomethyl)phenyl]acetamide Traditional Name: 2-[[3-(2-chlorophenyl)-4-keto-quinazolin-2-yl]thio]-N-[4-(cyanomethyl)phenyl]acetamide Formula: C24H17ClN4O2S MolecularWeight: 460.93538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NC3=CC=C(C=C3)CC#N)C4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NC3=CC=C(C=C3)CC#N)C4=CC=CC=C4Cl

InChI

InChI=1S/C24H17ClN4O2S/c25-19-6-2-4-8-21(19)29-23(31)18-5-1-3-7-20(18)28-24(29)32-15-22(30)27-17-11-9-16(10-12-17)13-14-26/h1-12H,13,15H2,(H,27,30)