N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-2-(4-phenylquinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-2-(4-phenylquinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-benzoyl-4-chloro-phenyl)-2-(4-phenylquinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(2-benzoyl-4-chlorophenyl)-2-[(4-phenyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-(2-benzoyl-4-chlorophenyl)-2-(4-phenylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(2-benzoyl-4-chloro-phenyl)-2-[(4-phenylquinazolin-2-yl)thio]acetamide Formula: C29H20ClN3O2S MolecularWeight: 510.006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC3=CC=CC=C32)SCC(=O)NC4=C(C=C(C=C4)Cl)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC3=CC=CC=C32)SCC(=O)NC4=C(C=C(C=C4)Cl)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H20ClN3O2S/c30-21-15-16-25(23(17-21)28(35)20-11-5-2-6-12-20)31-26(34)18-36-29-32-24-14-8-7-13-22(24)27(33-29)19-9-3-1-4-10-19/h1-17H,18H2,(H,31,34)