N-[4-(pyrrolidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide

Systemtic Name: N-[4-(pyrrolidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide Openeye Name: N-[4-(pyrrolidin-1-ium-1-ylmethyl)thiazol-2-yl]-1H-indazole-3-carboxamide CAS Name: N-[4-(1-pyrrolidin-1-iumylmethyl)-2-thiazolyl]-1H-indazole-3-carboxamide IUPAC Name: N-[4-(pyrrolidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide Traditional Name: N-[4-(pyrrolidin-1-ium-1-ylmethyl)thiazol-2-yl]-1H-indazole-3-carboxamide Formula: C16H18N5OS+ MolecularWeight: 328.41202

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CSC(=N2)NC(=O)C3=NNC4=CC=CC=C43

Isomeric SMILES

C1CC[NH+](C1)CC2=CSC(=N2)NC(=O)C3=NNC4=CC=CC=C43

InChI

InChI=1S/C16H17N5OS/c22-15(14-12-5-1-2-6-13(12)19-20-14)18-16-17-11(10-23-16)9-21-7-3-4-8-21/h1-2,5-6,10H,3-4,7-9H2,(H,19,20)(H,17,18,22)/p+1