N-[1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrazol-4-yl]propane-1-sulfonamide

Systemtic Name: N-[1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrazol-4-yl]propane-1-sulfonamide Openeye Name: N-[1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrazol-4-yl]propane-1-sulfonamide CAS Name: N-[1-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-4-pyrazolyl]-1-propanesulfonamide IUPAC Name: N-[1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrazol-4-yl]propane-1-sulfonamide Traditional Name: N-[1-[4-[4-(2-pyrimidyl)piperazino]butyl]pyrazol-4-yl]propane-1-sulfonamide Formula: C18H29N7O2S MolecularWeight: 407.53356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)NC1=CN(N=C1)CCCCN2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CCCS(=O)(=O)NC1=CN(N=C1)CCCCN2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C18H29N7O2S/c1-2-14-28(26,27)22-17-15-21-25(16-17)9-4-3-8-23-10-12-24(13-11-23)18-19-6-5-7-20-18/h5-7,15-16,22H,2-4,8-14H2,1H3