4-(2-chlorophenyl)-1-[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole

Systemtic Name: 4-(2-chlorophenyl)-1-[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole Openeye Name: 4-(2-chlorophenyl)-1-[3-nitro-4-(p-tolylsulfanyl)phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole CAS Name: 4-(2-chlorophenyl)-1-[4-[(4-methylphenyl)thio]-3-nitrophenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole IUPAC Name: 4-(2-chlorophenyl)-1-[4-(4-methylphenyl)sulfanyl-3-nitrophenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole Traditional Name: 4-(2-chlorophenyl)-1-[3-nitro-4-(p-tolylthio)phenyl]-2,3,4,9-tetrahydro-1H-$b-carboline Formula: C30H24ClN3O2S MolecularWeight: 526.04846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C3C4=C(C(CN3)C5=CC=CC=C5Cl)C6=CC=CC=C6N4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C3C4=C(C(CN3)C5=CC=CC=C5Cl)C6=CC=CC=C6N4)[N+](=O)[O-]

InChI

InChI=1S/C30H24ClN3O2S/c1-18-10-13-20(14-11-18)37-27-15-12-19(16-26(27)34(35)36)29-30-28(22-7-3-5-9-25(22)33-30)23(17-32-29)21-6-2-4-8-24(21)31/h2-16,23,29,32-33H,17H2,1H3