2-[(6-chloranyl-2-phenyl-quinazolin-4-yl)sulfanylmethyl]-3-phenyl-quinazolin-4-one

Systemtic Name: 2-[(6-chloranyl-2-phenyl-quinazolin-4-yl)sulfanylmethyl]-3-phenyl-quinazolin-4-one Openeye Name: 2-[(6-chloro-2-phenyl-quinazolin-4-yl)sulfanylmethyl]-3-phenyl-quinazolin-4-one CAS Name: 2-[[(6-chloro-2-phenyl-4-quinazolinyl)thio]methyl]-3-phenyl-4-quinazolinone IUPAC Name: 2-[(6-chloro-2-phenylquinazolin-4-yl)sulfanylmethyl]-3-phenylquinazolin-4-one Traditional Name: 2-[[(6-chloro-2-phenyl-quinazolin-4-yl)thio]methyl]-3-phenyl-quinazolin-4-one Formula: C29H19ClN4OS MolecularWeight: 507.00536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Cl)C(=N2)SCC4=NC5=CC=CC=C5C(=O)N4C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Cl)C(=N2)SCC4=NC5=CC=CC=C5C(=O)N4C6=CC=CC=C6

InChI

InChI=1S/C29H19ClN4OS/c30-20-15-16-25-23(17-20)28(33-27(32-25)19-9-3-1-4-10-19)36-18-26-31-24-14-8-7-13-22(24)29(35)34(26)21-11-5-2-6-12-21/h1-17H,18H2