N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1,3,5-trimethyl-pyrazole-4-sulfonamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1,3,5-trimethyl-pyrazole-4-sulfonamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1,3,5-trimethyl-pyrazole-4-sulfonamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-1,3,5-trimethyl-4-pyrazolesulfonamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1,3,5-trimethylpyrazole-4-sulfonamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1,3,5-trimethyl-pyrazole-4-sulfonamide Formula: C18H28N5O2S+ MolecularWeight: 378.51222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=C(N(N=C3C)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=C(N(N=C3C)C)C

InChI

InChI=1S/C18H27N5O2S/c1-5-22-10-12-23(13-11-22)17-8-6-16(7-9-17)20-26(24,25)18-14(2)19-21(4)15(18)3/h6-9,20H,5,10-13H2,1-4H3/p+1