5,5-dimethyl-3-phenyl-2-(phenylmethylsulfanyl)-6H-benzo[h]quinazolin-4-one

Systemtic Name: 5,5-dimethyl-3-phenyl-2-(phenylmethylsulfanyl)-6H-benzo[h]quinazolin-4-one Openeye Name: 2-benzylsulfanyl-5,5-dimethyl-3-phenyl-6H-benzo[h]quinazolin-4-one CAS Name: 5,5-dimethyl-3-phenyl-2-(phenylmethylthio)-6H-benzo[h]quinazolin-4-one IUPAC Name: 2-benzylsulfanyl-5,5-dimethyl-3-phenyl-6H-benzo[h]quinazolin-4-one Traditional Name: 2-(benzylthio)-5,5-dimethyl-3-phenyl-6H-benzo[h]quinazolin-4-one Formula: C27H24N2OS MolecularWeight: 424.55726

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)SCC4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)SCC4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C27H24N2OS/c1-27(2)17-20-13-9-10-16-22(20)24-23(27)25(30)29(21-14-7-4-8-15-21)26(28-24)31-18-19-11-5-3-6-12-19/h3-16H,17-18H2,1-2H3