N-pentan-3-yl-6-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propylamino]pyridine-3-sulfonamide

Systemtic Name: N-pentan-3-yl-6-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propylamino]pyridine-3-sulfonamide Openeye Name: N-(1-ethylpropyl)-6-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propylamino]pyridine-3-sulfonamide CAS Name: N-pentan-3-yl-6-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propylamino]-3-pyridinesulfonamide IUPAC Name: N-pentan-3-yl-6-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propylamino]pyridine-3-sulfonamide Traditional Name: N-(1-ethylpropyl)-6-[3-[4-(2-pyrimidyl)piperazino]propylamino]pyridine-3-sulfonamide Formula: C21H33N7O2S MolecularWeight: 447.59742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NS(=O)(=O)C1=CN=C(C=C1)NCCCN2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CCC(CC)NS(=O)(=O)C1=CN=C(C=C1)NCCCN2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C21H33N7O2S/c1-3-18(4-2)26-31(29,30)19-7-8-20(25-17-19)22-11-6-12-27-13-15-28(16-14-27)21-23-9-5-10-24-21/h5,7-10,17-18,26H,3-4,6,11-16H2,1-2H3,(H,22,25)