3-methyl-2-phenacylsulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one

Systemtic Name: 3-methyl-2-phenacylsulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Openeye Name: 3-methyl-2-phenacylsulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one CAS Name: 3-methyl-2-(phenacylthio)-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]one IUPAC Name: 3-methyl-2-phenacylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Traditional Name: 3-methyl-2-(phenacylthio)spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Formula: C25H24N2O2S MolecularWeight: 416.53526

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC(=O)C5=CC=CC=C5

Isomeric SMILES

CN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H24N2O2S/c1-27-23(29)21-22(26-24(27)30-16-20(28)17-9-3-2-4-10-17)19-12-6-5-11-18(19)15-25(21)13-7-8-14-25/h2-6,9-12H,7-8,13-16H2,1H3