N-ethyl-1-(4-piperazin-1-yl-4-pyrimidin-2-yl-butyl)pyrazole-4-sulfonamide

Systemtic Name: N-ethyl-1-(4-piperazin-1-yl-4-pyrimidin-2-yl-butyl)pyrazole-4-sulfonamide Openeye Name: N-ethyl-1-(4-piperazin-1-yl-4-pyrimidin-2-yl-butyl)pyrazole-4-sulfonamide CAS Name: N-ethyl-1-[4-(1-piperazinyl)-4-(2-pyrimidinyl)butyl]-4-pyrazolesulfonamide IUPAC Name: N-ethyl-1-(4-piperazin-1-yl-4-pyrimidin-2-ylbutyl)pyrazole-4-sulfonamide Traditional Name: N-ethyl-1-[4-piperazino-4-(2-pyrimidyl)butyl]pyrazole-4-sulfonamide Formula: C17H27N7O2S MolecularWeight: 393.50698

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Descriptors Computed from Structure

Canonical SMILES:

CCNS(=O)(=O)C1=CN(N=C1)CCCC(C2=NC=CC=N2)N3CCNCC3

Isomeric SMILES

CCNS(=O)(=O)C1=CN(N=C1)CCCC(C2=NC=CC=N2)N3CCNCC3

InChI

InChI=1S/C17H27N7O2S/c1-2-22-27(25,26)15-13-21-24(14-15)10-3-5-16(17-19-6-4-7-20-17)23-11-8-18-9-12-23/h4,6-7,13-14,16,18,22H,2-3,5,8-12H2,1H3