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

Systemtic Name: 2-[7-chloranyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-N-(2-cyanophenyl)ethanamide Openeye Name: 2-(3-benzyl-7-chloro-4-oxo-quinazolin-2-yl)sulfanyl-N-(2-cyanophenyl)acetamide CAS Name: 2-[[7-chloro-4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]-N-(2-cyanophenyl)acetamide IUPAC Name: 2-(3-benzyl-7-chloro-4-oxoquinazolin-2-yl)sulfanyl-N-(2-cyanophenyl)acetamide Traditional Name: 2-[(3-benzyl-7-chloro-4-keto-quinazolin-2-yl)thio]-N-(2-cyanophenyl)acetamide Formula: C24H17ClN4O2S MolecularWeight: 460.93538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC4=CC=CC=C4C#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC4=CC=CC=C4C#N

InChI

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