6-[4-(6-iodanyl-2-methyl-4-oxidanylidene-quinazolin-3-yl)phenyl]-4-(4-methoxyphenyl)-2-sulfanylidene-1H-pyridine-3-carbonitrile

Systemtic Name: 6-[4-(6-iodanyl-2-methyl-4-oxidanylidene-quinazolin-3-yl)phenyl]-4-(4-methoxyphenyl)-2-sulfanylidene-1H-pyridine-3-carbonitrile Openeye Name: 6-[4-(6-iodo-2-methyl-4-oxo-quinazolin-3-yl)phenyl]-4-(4-methoxyphenyl)-2-thioxo-1H-pyridine-3-carbonitrile CAS Name: 6-[4-(6-iodo-2-methyl-4-oxo-3-quinazolinyl)phenyl]-4-(4-methoxyphenyl)-2-sulfanylidene-1H-pyridine-3-carbonitrile IUPAC Name: 6-[4-(6-iodo-2-methyl-4-oxoquinazolin-3-yl)phenyl]-4-(4-methoxyphenyl)-2-sulfanylidene-1H-pyridine-3-carbonitrile Traditional Name: 6-[4-(6-iodo-4-keto-2-methyl-quinazolin-3-yl)phenyl]-4-(4-methoxyphenyl)-2-thioxo-1H-pyridine-3-carbonitrile Formula: C28H19IN4O2S MolecularWeight: 602.44553

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=CC=C(C=C3)C4=CC(=C(C(=S)N4)C#N)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=CC=C(C=C3)C4=CC(=C(C(=S)N4)C#N)C5=CC=C(C=C5)OC

InChI

InChI=1S/C28H19IN4O2S/c1-16-31-25-12-7-19(29)13-23(25)28(34)33(16)20-8-3-18(4-9-20)26-14-22(24(15-30)27(36)32-26)17-5-10-21(35-2)11-6-17/h3-14H,1-2H3,(H,32,36)