2-[6-iodanyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-N,N-diphenyl-ethanamide

Systemtic Name: 2-[6-iodanyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-N,N-diphenyl-ethanamide Openeye Name: 2-(3-benzyl-6-iodo-4-oxo-quinazolin-2-yl)sulfanyl-N,N-diphenyl-acetamide CAS Name: 2-[[6-iodo-4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]-N,N-diphenylacetamide IUPAC Name: 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diphenylacetamide Traditional Name: 2-[(3-benzyl-6-iodo-4-keto-quinazolin-2-yl)thio]-N,N-diphenyl-acetamide Formula: C29H22IN3O2S MolecularWeight: 603.47335

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)N(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)N(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H22IN3O2S/c30-22-16-17-26-25(18-22)28(35)32(19-21-10-4-1-5-11-21)29(31-26)36-20-27(34)33(23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-18H,19-20H2