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

Systemtic Name: (2S)-N-aminocarbonyl-2-(4-pyrrolidin-1-ylsulfonylpiperazin-1-ium-1-yl)propanamide Openeye Name: (2S)-N-carbamoyl-2-(4-pyrrolidin-1-ylsulfonylpiperazin-1-ium-1-yl)propanamide CAS Name: (2S)-N-carbamoyl-2-[4-(1-pyrrolidinylsulfonyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2S)-N-carbamoyl-2-(4-pyrrolidin-1-ylsulfonylpiperazin-1-ium-1-yl)propanamide Traditional Name: (2S)-N-carbamoyl-2-(4-pyrrolidinosulfonylpiperazin-1-ium-1-yl)propionamide Formula: C12H24N5O4S+ MolecularWeight: 334.41506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H23N5O4S/c1-10(11(18)14-12(13)19)15-6-8-17(9-7-15)22(20,21)16-4-2-3-5-16/h10H,2-9H2,1H3,(H3,13,14,18,19)/p+1/t10-/m0/s1