4-methyl-9-(4-methylphenyl)sulfonyl-6-piperidin-1-yl-pyrido[3,4-b]indole-3-carbaldehyde

Systemtic Name: 4-methyl-9-(4-methylphenyl)sulfonyl-6-piperidin-1-yl-pyrido[3,4-b]indole-3-carbaldehyde Openeye Name: 4-methyl-6-(1-piperidyl)-9-(p-tolylsulfonyl)pyrido[3,4-b]indole-3-carbaldehyde CAS Name: 4-methyl-9-(4-methylphenyl)sulfonyl-6-(1-piperidinyl)-3-pyrido[3,4-b]indolecarboxaldehyde IUPAC Name: 4-methyl-9-(4-methylphenyl)sulfonyl-6-piperidin-1-ylpyrido[3,4-b]indole-3-carbaldehyde Traditional Name: 4-methyl-6-piperidino-9-tosyl-$b-carboline-3-carbaldehyde Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)N4CCCCC4)C5=C(C(=NC=C52)C=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)N4CCCCC4)C5=C(C(=NC=C52)C=O)C

InChI

InChI=1S/C25H25N3O3S/c1-17-6-9-20(10-7-17)32(30,31)28-23-11-8-19(27-12-4-3-5-13-27)14-21(23)25-18(2)22(16-29)26-15-24(25)28/h6-11,14-16H,3-5,12-13H2,1-2H3