3-(4-methylphenyl)-2-[(2-methylphenyl)methylsulfanyl]spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one

Systemtic Name: 3-(4-methylphenyl)-2-[(2-methylphenyl)methylsulfanyl]spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Openeye Name: 2-(o-tolylmethylsulfanyl)-3-(p-tolyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one CAS Name: 3-(4-methylphenyl)-2-[(2-methylphenyl)methylthio]-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]one IUPAC Name: 3-(4-methylphenyl)-2-[(2-methylphenyl)methylsulfanyl]spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Traditional Name: 2-[(2-methylbenzyl)thio]-3-(p-tolyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Formula: C32H32N2OS MolecularWeight: 492.67428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC6=CC=CC=C6C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC6=CC=CC=C6C

InChI

InChI=1S/C32H32N2OS/c1-22-14-16-26(17-15-22)34-30(35)28-29(33-31(34)36-21-25-12-5-4-10-23(25)2)27-13-7-6-11-24(27)20-32(28)18-8-3-9-19-32/h4-7,10-17H,3,8-9,18-21H2,1-2H3