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

Systemtic Name: 6-[4-(6-iodanyl-2-methyl-4-oxidanylidene-quinazolin-3-yl)phenyl]-4-(4-methylphenyl)-2-sulfanylidene-1H-pyridine-3-carbonitrile Openeye Name: 6-[4-(6-iodo-2-methyl-4-oxo-quinazolin-3-yl)phenyl]-4-(p-tolyl)-2-thioxo-1H-pyridine-3-carbonitrile CAS Name: 6-[4-(6-iodo-2-methyl-4-oxo-3-quinazolinyl)phenyl]-4-(4-methylphenyl)-2-sulfanylidene-1H-pyridine-3-carbonitrile IUPAC Name: 6-[4-(6-iodo-2-methyl-4-oxoquinazolin-3-yl)phenyl]-4-(4-methylphenyl)-2-sulfanylidene-1H-pyridine-3-carbonitrile Traditional Name: 6-[4-(6-iodo-4-keto-2-methyl-quinazolin-3-yl)phenyl]-4-(p-tolyl)-2-thioxo-1H-pyridine-3-carbonitrile Formula: C28H19IN4OS MolecularWeight: 586.44613

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=S)NC(=C2)C3=CC=C(C=C3)N4C(=NC5=C(C4=O)C=C(C=C5)I)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=S)NC(=C2)C3=CC=C(C=C3)N4C(=NC5=C(C4=O)C=C(C=C5)I)C)C#N

InChI

InChI=1S/C28H19IN4OS/c1-16-3-5-18(6-4-16)22-14-26(32-27(35)24(22)15-30)19-7-10-21(11-8-19)33-17(2)31-25-12-9-20(29)13-23(25)28(33)34/h3-14H,1-2H3,(H,32,35)