2-butyl-4-methylidene-9-(4-methylphenyl)sulfonyl-7-(trifluoromethyl)-1,3-dihydropyrido[3,4-b]indole

Systemtic Name: 2-butyl-4-methylidene-9-(4-methylphenyl)sulfonyl-7-(trifluoromethyl)-1,3-dihydropyrido[3,4-b]indole Openeye Name: 2-butyl-4-methylene-9-(p-tolylsulfonyl)-7-(trifluoromethyl)-1,3-dihydropyrido[3,4-b]indole CAS Name: 2-butyl-4-methylene-9-(4-methylphenyl)sulfonyl-7-(trifluoromethyl)-1,3-dihydropyrido[3,4-b]indole IUPAC Name: 2-butyl-4-methylidene-9-(4-methylphenyl)sulfonyl-7-(trifluoromethyl)-1,3-dihydropyrido[3,4-b]indole Traditional Name: 2-butyl-4-methylene-9-tosyl-7-(trifluoromethyl)-1,3-dihydro-$b-carboline Formula: C24H25F3N2O2S MolecularWeight: 462.52771

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(=C)C2=C(C1)N(C3=C2C=CC(=C3)C(F)(F)F)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCN1CC(=C)C2=C(C1)N(C3=C2C=CC(=C3)C(F)(F)F)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C24H25F3N2O2S/c1-4-5-12-28-14-17(3)23-20-11-8-18(24(25,26)27)13-21(20)29(22(23)15-28)32(30,31)19-9-6-16(2)7-10-19/h6-11,13H,3-5,12,14-15H2,1-2H3