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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC3=C(C(=O)N2CCC4=CC=CC=C4)C5(CCCC5)CC6=CC=CC=C63

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC3=C(C(=O)N2CCC4=CC=CC=C4)C5(CCCC5)CC6=CC=CC=C63

InChI

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