(2S)-2-chloranyl-N-[5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: (2S)-2-chloranyl-N-[5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: (2S)-2-chloro-N-[5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: (2S)-2-chloro-N-[5-(1-pyrrolidin-1-iumylmethyl)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: (2S)-2-chloro-N-[5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: (2S)-2-chloro-N-[5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-thiadiazol-2-yl]propionamide Formula: C10H16ClN4OS+ MolecularWeight: 275.77824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NN=C(S1)C[NH+]2CCCC2)Cl

Isomeric SMILES

C[C@@H](C(=O)NC1=NN=C(S1)C[NH+]2CCCC2)Cl

InChI

InChI=1S/C10H15ClN4OS/c1-7(11)9(16)12-10-14-13-8(17-10)6-15-4-2-3-5-15/h7H,2-6H2,1H3,(H,12,14,16)/p+1/t7-/m0/s1