3-(2-methylphenyl)-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2-methylphenyl)-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-quinazolin-4-one Openeye Name: 3-(o-tolyl)-2-[2-(2-thienyl)quinazolin-4-yl]sulfanyl-quinazolin-4-one CAS Name: 3-(2-methylphenyl)-2-[(2-thiophen-2-yl-4-quinazolinyl)thio]-4-quinazolinone IUPAC Name: 3-(2-methylphenyl)-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanylquinazolin-4-one Traditional Name: 3-(o-tolyl)-2-[[2-(2-thienyl)quinazolin-4-yl]thio]quinazolin-4-one Formula: C27H18N4OS2 MolecularWeight: 478.58802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SC4=NC(=NC5=CC=CC=C54)C6=CC=CS6

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SC4=NC(=NC5=CC=CC=C54)C6=CC=CS6

InChI

InChI=1S/C27H18N4OS2/c1-17-9-2-7-14-22(17)31-26(32)19-11-4-6-13-21(19)29-27(31)34-25-18-10-3-5-12-20(18)28-24(30-25)23-15-8-16-33-23/h2-16H,1H3