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

Systemtic Name: 2-[6-iodanyl-3-(4-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N,N-diphenyl-ethanamide Openeye Name: 2-[6-iodo-3-(4-methoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N,N-diphenyl-acetamide CAS Name: 2-[[6-iodo-3-(4-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]-N,N-diphenylacetamide IUPAC Name: 2-[6-iodo-3-(4-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N,N-diphenylacetamide Traditional Name: 2-[[6-iodo-4-keto-3-(4-methoxyphenyl)quinazolin-2-yl]thio]-N,N-diphenyl-acetamide Formula: C29H22IN3O3S MolecularWeight: 619.47275

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)N(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)N(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H22IN3O3S/c1-36-24-15-13-23(14-16-24)33-28(35)25-18-20(30)12-17-26(25)31-29(33)37-19-27(34)32(21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-18H,19H2,1H3