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

Systemtic Name: 2-[(4-methylphenyl)methylsulfanyl]-3-phenyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Openeye Name: 3-phenyl-2-(p-tolylmethylsulfanyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one CAS Name: 2-[(4-methylphenyl)methylthio]-3-phenyl-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]one IUPAC Name: 2-[(4-methylphenyl)methylsulfanyl]-3-phenylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Traditional Name: 2-[(4-methylbenzyl)thio]-3-phenyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Formula: C30H28N2OS MolecularWeight: 464.62112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC3=C(C(=O)N2C4=CC=CC=C4)C5(CCCC5)CC6=CC=CC=C63

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=C(C(=O)N2C4=CC=CC=C4)C5(CCCC5)CC6=CC=CC=C63

InChI

InChI=1S/C30H28N2OS/c1-21-13-15-22(16-14-21)20-34-29-31-27-25-12-6-5-9-23(25)19-30(17-7-8-18-30)26(27)28(33)32(29)24-10-3-2-4-11-24/h2-6,9-16H,7-8,17-20H2,1H3