2-[6-iodanyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-N-[(E)-(phenylmethylidene)amino]ethanamide

Systemtic Name: 2-[6-iodanyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-N-[(E)-(phenylmethylidene)amino]ethanamide Openeye Name: N-[(E)-benzylideneamino]-2-(3-benzyl-6-iodo-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: 2-[[6-iodo-4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]-N-[(E)-(phenylmethylene)amino]acetamide IUPAC Name: N-[(E)-benzylideneamino]-2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-[(E)-benzalamino]-2-[(3-benzyl-6-iodo-4-keto-quinazolin-2-yl)thio]acetamide Formula: C24H19IN4O2S MolecularWeight: 554.40273

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)NN=CC4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C24H19IN4O2S/c25-19-11-12-21-20(13-19)23(31)29(15-18-9-5-2-6-10-18)24(27-21)32-16-22(30)28-26-14-17-7-3-1-4-8-17/h1-14H,15-16H2,(H,28,30)/b26-14+