2-[7-chloranyl-3-(4-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(1-cyanocyclohexyl)ethanamide

Systemtic Name: 2-[7-chloranyl-3-(4-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(1-cyanocyclohexyl)ethanamide Openeye Name: 2-[7-chloro-3-(4-chlorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(1-cyanocyclohexyl)acetamide CAS Name: 2-[[7-chloro-3-(4-chlorophenyl)-4-oxo-2-quinazolinyl]thio]-N-(1-cyanocyclohexyl)acetamide IUPAC Name: 2-[7-chloro-3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(1-cyanocyclohexyl)acetamide Traditional Name: 2-[[7-chloro-3-(4-chlorophenyl)-4-keto-quinazolin-2-yl]thio]-N-(1-cyanocyclohexyl)acetamide Formula: C23H20Cl2N4O2S MolecularWeight: 487.4015

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#N)NC(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCC(CC1)(C#N)NC(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H20Cl2N4O2S/c24-15-4-7-17(8-5-15)29-21(31)18-9-6-16(25)12-19(18)27-22(29)32-13-20(30)28-23(14-26)10-2-1-3-11-23/h4-9,12H,1-3,10-11,13H2,(H,28,30)