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

Systemtic Name: 2,2-dimethyl-3-piperazin-4-ium-1-ylsulfonyl-N-pyrimidin-2-yl-propanamide Openeye Name: 2,2-dimethyl-3-piperazin-4-ium-1-ylsulfonyl-N-pyrimidin-2-yl-propanamide CAS Name: 2,2-dimethyl-3-(1-piperazin-4-iumylsulfonyl)-N-(2-pyrimidinyl)propanamide IUPAC Name: 2,2-dimethyl-3-piperazin-4-ium-1-ylsulfonyl-N-pyrimidin-2-ylpropanamide Traditional Name: 2,2-dimethyl-3-piperazin-4-ium-1-ylsulfonyl-N-(2-pyrimidyl)propionamide Formula: C13H22N5O3S+ MolecularWeight: 328.41048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CS(=O)(=O)N1CC[NH2+]CC1)C(=O)NC2=NC=CC=N2

Isomeric SMILES

CC(C)(CS(=O)(=O)N1CC[NH2+]CC1)C(=O)NC2=NC=CC=N2

InChI

InChI=1S/C13H21N5O3S/c1-13(2,11(19)17-12-15-4-3-5-16-12)10-22(20,21)18-8-6-14-7-9-18/h3-5,14H,6-10H2,1-2H3,(H,15,16,17,19)/p+1