2-[1-piperazin-1-yl-4-(4-sulfonyl-3H-pyrazol-2-yl)butyl]pyrimidine

Systemtic Name: 2-[1-piperazin-1-yl-4-(4-sulfonyl-3H-pyrazol-2-yl)butyl]pyrimidine Openeye Name: 2-[1-piperazin-1-yl-4-(4-sulfonyl-3H-pyrazol-2-yl)butyl]pyrimidine CAS Name: 2-[1-(1-piperazinyl)-4-(4-sulfonyl-3H-pyrazol-2-yl)butyl]pyrimidine IUPAC Name: 2-[1-piperazin-1-yl-4-(4-sulfonyl-3H-pyrazol-2-yl)butyl]pyrimidine Traditional Name: 2-[1-piperazino-4-(4-sulfonyl-2-pyrazolin-1-yl)butyl]pyrimidine Formula: C15H22N6O2S MolecularWeight: 350.43918

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(CCCN2CC(=S(=O)=O)C=N2)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1)C(CCCN2CC(=S(=O)=O)C=N2)C3=NC=CC=N3

InChI

InChI=1S/C15H22N6O2S/c22-24(23)13-11-19-21(12-13)8-1-3-14(15-17-4-2-5-18-15)20-9-6-16-7-10-20/h2,4-5,11,14,16H,1,3,6-10,12H2