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

Systemtic Name: 5-cyclohexyl-5-methyl-3-phenyl-2-(phenylmethylsulfanyl)-6H-benzo[h]quinazolin-4-one Openeye Name: 2-benzylsulfanyl-5-cyclohexyl-5-methyl-3-phenyl-6H-benzo[h]quinazolin-4-one CAS Name: 5-cyclohexyl-5-methyl-3-phenyl-2-(phenylmethylthio)-6H-benzo[h]quinazolin-4-one IUPAC Name: 2-benzylsulfanyl-5-cyclohexyl-5-methyl-3-phenyl-6H-benzo[h]quinazolin-4-one Traditional Name: 2-(benzylthio)-5-cyclohexyl-5-methyl-3-phenyl-6H-benzo[h]quinazolin-4-one Formula: C32H32N2OS MolecularWeight: 492.67428

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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)C6CCCCC6

Isomeric SMILES

CC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)SCC4=CC=CC=C4)C5=CC=CC=C5)C6CCCCC6

InChI

InChI=1S/C32H32N2OS/c1-32(25-16-7-3-8-17-25)21-24-15-11-12-20-27(24)29-28(32)30(35)34(26-18-9-4-10-19-26)31(33-29)36-22-23-13-5-2-6-14-23/h2,4-6,9-15,18-20,25H,3,7-8,16-17,21-22H2,1H3