(2S)-N-(methylcarbamoyl)-2-(4-pyrrolidin-1-ylsulfonylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: (2S)-N-(methylcarbamoyl)-2-(4-pyrrolidin-1-ylsulfonylpiperazin-1-ium-1-yl)propanamide Openeye Name: (2S)-N-(methylcarbamoyl)-2-(4-pyrrolidin-1-ylsulfonylpiperazin-1-ium-1-yl)propanamide CAS Name: (2S)-N-(methylcarbamoyl)-2-[4-(1-pyrrolidinylsulfonyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2S)-N-(methylcarbamoyl)-2-(4-pyrrolidin-1-ylsulfonylpiperazin-1-ium-1-yl)propanamide Traditional Name: (2S)-N-(methylcarbamoyl)-2-(4-pyrrolidinosulfonylpiperazin-1-ium-1-yl)propionamide Formula: C13H26N5O4S+ MolecularWeight: 348.44164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC)[NH+]1CCN(CC1)S(=O)(=O)N2CCCC2

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC)[NH+]1CCN(CC1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C13H25N5O4S/c1-11(12(19)15-13(20)14-2)16-7-9-18(10-8-16)23(21,22)17-5-3-4-6-17/h11H,3-10H2,1-2H3,(H2,14,15,19,20)/p+1/t11-/m0/s1