N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]acetamide Formula: C24H17ClN6O2S MolecularWeight: 488.94878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=C(C=CC(=C4)Cl)N5C=NC=N5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=C(C=CC(=C4)Cl)N5C=NC=N5

InChI

InChI=1S/C24H17ClN6O2S/c25-16-10-11-21(30-15-26-14-27-30)20(12-16)28-22(32)13-34-24-29-19-9-5-4-8-18(19)23(33)31(24)17-6-2-1-3-7-17/h1-12,14-15H,13H2,(H,28,32)