2,2-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide

Systemtic Name: 2,2-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide Openeye Name: 2,2-dimethyl-N-(4-methylthiazol-2-yl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide CAS Name: 2,2-dimethyl-N-(4-methyl-2-thiazolyl)-3-(1-piperazin-4-iumylsulfonyl)propanamide IUPAC Name: 2,2-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)-3-piperazin-4-ium-1-ylsulfonylpropanamide Traditional Name: 2,2-dimethyl-N-(4-methylthiazol-2-yl)-3-piperazin-4-ium-1-ylsulfonyl-propionamide Formula: C13H23N4O3S2+ MolecularWeight: 347.47672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)C(C)(C)CS(=O)(=O)N2CC[NH2+]CC2

Isomeric SMILES

CC1=CSC(=N1)NC(=O)C(C)(C)CS(=O)(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C13H22N4O3S2/c1-10-8-21-12(15-10)16-11(18)13(2,3)9-22(19,20)17-6-4-14-5-7-17/h8,14H,4-7,9H2,1-3H3,(H,15,16,18)/p+1