N-(4-chlorophenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: N-(4-chlorophenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-thiadiazole-2-carboxamide Openeye Name: N-(4-chlorophenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-thiadiazole-2-carboxamide CAS Name: N-(4-chlorophenyl)-5-(1-pyrrolidin-1-iumylmethyl)-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-(4-chlorophenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-thiadiazole-2-carboxamide Traditional Name: N-(4-chlorophenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-thiadiazole-2-carboxamide Formula: C14H16ClN4OS+ MolecularWeight: 323.82104

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=NN=C(S2)C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC[NH+](C1)CC2=NN=C(S2)C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H15ClN4OS/c15-10-3-5-11(6-4-10)16-13(20)14-18-17-12(21-14)9-19-7-1-2-8-19/h3-6H,1-2,7-9H2,(H,16,20)/p+1