3-phenyl-2-[[2-(phenylmethyl)quinazolin-4-yl]sulfanylmethyl]quinazolin-4-one

Systemtic Name: 3-phenyl-2-[[2-(phenylmethyl)quinazolin-4-yl]sulfanylmethyl]quinazolin-4-one Openeye Name: 2-[(2-benzylquinazolin-4-yl)sulfanylmethyl]-3-phenyl-quinazolin-4-one CAS Name: 3-phenyl-2-[[[2-(phenylmethyl)-4-quinazolinyl]thio]methyl]-4-quinazolinone IUPAC Name: 2-[(2-benzylquinazolin-4-yl)sulfanylmethyl]-3-phenylquinazolin-4-one Traditional Name: 2-[[(2-benzylquinazolin-4-yl)thio]methyl]-3-phenyl-quinazolin-4-one Formula: C30H22N4OS MolecularWeight: 486.58688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC3=CC=CC=C3C(=N2)SCC4=NC5=CC=CC=C5C(=O)N4C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC3=CC=CC=C3C(=N2)SCC4=NC5=CC=CC=C5C(=O)N4C6=CC=CC=C6

InChI

InChI=1S/C30H22N4OS/c35-30-24-16-8-10-18-26(24)32-28(34(30)22-13-5-2-6-14-22)20-36-29-23-15-7-9-17-25(23)31-27(33-29)19-21-11-3-1-4-12-21/h1-18H,19-20H2