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

Systemtic Name: (2S)-2-methyl-3-piperazin-4-ium-1-ylsulfonyl-N-(1,3-thiazol-2-yl)propanamide Openeye Name: (2S)-2-methyl-3-piperazin-4-ium-1-ylsulfonyl-N-thiazol-2-yl-propanamide CAS Name: (2S)-2-methyl-3-(1-piperazin-4-iumylsulfonyl)-N-(2-thiazolyl)propanamide IUPAC Name: (2S)-2-methyl-3-piperazin-4-ium-1-ylsulfonyl-N-(1,3-thiazol-2-yl)propanamide Traditional Name: (2S)-2-methyl-3-piperazin-4-ium-1-ylsulfonyl-N-thiazol-2-yl-propionamide Formula: C11H19N4O3S2+ MolecularWeight: 319.42356

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)N1CC[NH2+]CC1)C(=O)NC2=NC=CS2

Isomeric SMILES

C[C@H](CS(=O)(=O)N1CC[NH2+]CC1)C(=O)NC2=NC=CS2

InChI

InChI=1S/C11H18N4O3S2/c1-9(10(16)14-11-13-4-7-19-11)8-20(17,18)15-5-2-12-3-6-15/h4,7,9,12H,2-3,5-6,8H2,1H3,(H,13,14,16)/p+1/t9-/m1/s1