8-(azepan-1-ylsulfonyl)-4-(4-methylsulfanylphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline

Systemtic Name: 8-(azepan-1-ylsulfonyl)-4-(4-methylsulfanylphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline Openeye Name: 8-(azepan-1-ylsulfonyl)-4-(4-methylsulfanylphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline CAS Name: 8-(1-azepanylsulfonyl)-4-[4-(methylthio)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline IUPAC Name: 8-(azepan-1-ylsulfonyl)-4-(4-methylsulfanylphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline Traditional Name: 8-(azepan-1-ylsulfonyl)-4-[4-(methylthio)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline Formula: C25H30N2O2S2 MolecularWeight: 454.6479

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2C3CC=CC3C4=C(N2)C=CC(=C4)S(=O)(=O)N5CCCCCC5

Isomeric SMILES

CSC1=CC=C(C=C1)C2C3CC=CC3C4=C(N2)C=CC(=C4)S(=O)(=O)N5CCCCCC5

InChI

InChI=1S/C25H30N2O2S2/c1-30-19-11-9-18(10-12-19)25-22-8-6-7-21(22)23-17-20(13-14-24(23)26-25)31(28,29)27-15-4-2-3-5-16-27/h6-7,9-14,17,21-22,25-26H,2-5,8,15-16H2,1H3