4-[[1-[2-[[(3S)-piperidin-3-yl]amino]pyridin-4-yl]-1,2,4-triazol-3-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[1-[2-[[(3S)-piperidin-3-yl]amino]pyridin-4-yl]-1,2,4-triazol-3-yl]amino]benzenesulfonamide Openeye Name: 4-[[1-[2-[[(3S)-3-piperidyl]amino]-4-pyridyl]-1,2,4-triazol-3-yl]amino]benzenesulfonamide CAS Name: 4-[[1-[2-[[(3S)-3-piperidinyl]amino]-4-pyridinyl]-1,2,4-triazol-3-yl]amino]benzenesulfonamide IUPAC Name: 4-[[1-[2-[[(3S)-piperidin-3-yl]amino]pyridin-4-yl]-1,2,4-triazol-3-yl]amino]benzenesulfonamide Traditional Name: 4-[[1-[2-[[(3S)-3-piperidyl]amino]-4-pyridyl]-1,2,4-triazol-3-yl]amino]benzenesulfonamide Formula: C18H22N8O2S MolecularWeight: 414.48468

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)NC2=NC=CC(=C2)N3C=NC(=N3)NC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1C[C@@H](CNC1)NC2=NC=CC(=C2)N3C=NC(=N3)NC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C18H22N8O2S/c19-29(27,28)16-5-3-13(4-6-16)24-18-22-12-26(25-18)15-7-9-21-17(10-15)23-14-2-1-8-20-11-14/h3-7,9-10,12,14,20H,1-2,8,11H2,(H,21,23)(H,24,25)(H2,19,27,28)/t14-/m0/s1