3-piperazin-4-ium-1-ylsulfonyl-N-pyrimidin-2-yl-propanamide

Systemtic Name: 3-piperazin-4-ium-1-ylsulfonyl-N-pyrimidin-2-yl-propanamide Openeye Name: 3-piperazin-4-ium-1-ylsulfonyl-N-pyrimidin-2-yl-propanamide CAS Name: 3-(1-piperazin-4-iumylsulfonyl)-N-(2-pyrimidinyl)propanamide IUPAC Name: 3-piperazin-4-ium-1-ylsulfonyl-N-pyrimidin-2-ylpropanamide Traditional Name: 3-piperazin-4-ium-1-ylsulfonyl-N-(2-pyrimidyl)propionamide Formula: C11H18N5O3S+ MolecularWeight: 300.35732

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)S(=O)(=O)CCC(=O)NC2=NC=CC=N2

Isomeric SMILES

C1CN(CC[NH2+]1)S(=O)(=O)CCC(=O)NC2=NC=CC=N2

InChI

InChI=1S/C11H17N5O3S/c17-10(15-11-13-3-1-4-14-11)2-9-20(18,19)16-7-5-12-6-8-16/h1,3-4,12H,2,5-9H2,(H,13,14,15,17)/p+1