4-[2-[[5-nitro-6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)pyrimidin-4-yl]amino]ethyl]benzenesulfonamide

Systemtic Name: 4-[2-[[5-nitro-6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)pyrimidin-4-yl]amino]ethyl]benzenesulfonamide Openeye Name: 4-[2-[[5-nitro-6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)pyrimidin-4-yl]amino]ethyl]benzenesulfonamide CAS Name: 4-[2-[[5-nitro-6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-4-pyrimidinyl]amino]ethyl]benzenesulfonamide IUPAC Name: 4-[2-[[5-nitro-6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)pyrimidin-4-yl]amino]ethyl]benzenesulfonamide Traditional Name: 4-[2-[[5-nitro-6-(1,3,4,9-tetrahydro-$b-carbolin-2-yl)pyrimidin-4-yl]amino]ethyl]benzenesulfonamide Formula: C23H23N7O4S MolecularWeight: 493.53822

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C3=CC=CC=C3N2)C4=C(C(=NC=N4)NCCC5=CC=C(C=C5)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=C1C3=CC=CC=C3N2)C4=C(C(=NC=N4)NCCC5=CC=C(C=C5)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C23H23N7O4S/c24-35(33,34)16-7-5-15(6-8-16)9-11-25-22-21(30(31)32)23(27-14-26-22)29-12-10-18-17-3-1-2-4-19(17)28-20(18)13-29/h1-8,14,28H,9-13H2,(H2,24,33,34)(H,25,26,27)