N-[(2R)-2-(1H-indol-3-yl)-2-phenyl-ethyl]-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-pyridin-2-amine

Systemtic Name: N-[(2R)-2-(1H-indol-3-yl)-2-phenyl-ethyl]-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-pyridin-2-amine Openeye Name: N-[(2R)-2-(1H-indol-3-yl)-2-phenyl-ethyl]-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-pyridin-2-amine CAS Name: N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]-5-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-2-pyridinamine IUPAC Name: N-[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]-5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-2-amine Traditional Name: [(2R)-2-(1H-indol-3-yl)-2-phenyl-ethyl]-[5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-2-pyridyl]amine Formula: C26H30N5O2S+ MolecularWeight: 476.6137

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)NCC(C3=CC=CC=C3)C4=CNC5=CC=CC=C54

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)NC[C@H](C3=CC=CC=C3)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C26H29N5O2S/c1-30-13-15-31(16-14-30)34(32,33)21-11-12-26(28-17-21)29-18-23(20-7-3-2-4-8-20)24-19-27-25-10-6-5-9-22(24)25/h2-12,17,19,23,27H,13-16,18H2,1H3,(H,28,29)/p+1/t23-/m1/s1