2-[3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-cyanoethyl)-N-phenyl-propanamide

Systemtic Name: 2-[3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-cyanoethyl)-N-phenyl-propanamide Openeye Name: 2-[3-(2-chlorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(2-cyanoethyl)-N-phenyl-propanamide CAS Name: 2-[[3-(2-chlorophenyl)-4-oxo-2-quinazolinyl]thio]-N-(2-cyanoethyl)-N-phenylpropanamide IUPAC Name: 2-[3-(2-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-cyanoethyl)-N-phenylpropanamide Traditional Name: 2-[[3-(2-chlorophenyl)-4-keto-quinazolin-2-yl]thio]-N-(2-cyanoethyl)-N-phenyl-propionamide Formula: C26H21ClN4O2S MolecularWeight: 488.98854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(CCC#N)C1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4Cl

Isomeric SMILES

CC(C(=O)N(CCC#N)C1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4Cl

InChI

InChI=1S/C26H21ClN4O2S/c1-18(24(32)30(17-9-16-28)19-10-3-2-4-11-19)34-26-29-22-14-7-5-12-20(22)25(33)31(26)23-15-8-6-13-21(23)27/h2-8,10-15,18H,9,17H2,1H3