2-[3-(3-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(diphenylmethyl)ethanamide

Systemtic Name: 2-[3-(3-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(diphenylmethyl)ethanamide Openeye Name: N-benzhydryl-2-[3-(3-chlorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: 2-[[3-(3-chlorophenyl)-4-oxo-2-quinazolinyl]thio]-N-(diphenylmethyl)acetamide IUPAC Name: N-benzhydryl-2-[3-(3-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-benzhydryl-2-[[3-(3-chlorophenyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C29H22ClN3O2S MolecularWeight: 512.02188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC(=CC=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC(=CC=C5)Cl

InChI

InChI=1S/C29H22ClN3O2S/c30-22-14-9-15-23(18-22)33-28(35)24-16-7-8-17-25(24)31-29(33)36-19-26(34)32-27(20-10-3-1-4-11-20)21-12-5-2-6-13-21/h1-18,27H,19H2,(H,32,34)