N-cyclopentyl-1-[(3S)-1-(thiophen-2-ylmethyl)piperidin-1-ium-3-yl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-cyclopentyl-1-[(3S)-1-(thiophen-2-ylmethyl)piperidin-1-ium-3-yl]-1,2,3-triazole-4-carboxamide Openeye Name: N-cyclopentyl-1-[(3S)-1-(2-thienylmethyl)piperidin-1-ium-3-yl]triazole-4-carboxamide CAS Name: N-cyclopentyl-1-[(3S)-1-(thiophen-2-ylmethyl)-3-piperidin-1-iumyl]-4-triazolecarboxamide IUPAC Name: N-cyclopentyl-1-[(3S)-1-(thiophen-2-ylmethyl)piperidin-1-ium-3-yl]triazole-4-carboxamide Traditional Name: N-cyclopentyl-1-[(3S)-1-(2-thenyl)piperidin-1-ium-3-yl]triazole-4-carboxamide Formula: C18H26N5OS+ MolecularWeight: 360.49694

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2=CN(N=N2)C3CCC[NH+](C3)CC4=CC=CS4

Isomeric SMILES

C1CCC(C1)NC(=O)C2=CN(N=N2)[C@H]3CCC[NH+](C3)CC4=CC=CS4

InChI

InChI=1S/C18H25N5OS/c24-18(19-14-5-1-2-6-14)17-13-23(21-20-17)15-7-3-9-22(11-15)12-16-8-4-10-25-16/h4,8,10,13-15H,1-3,5-7,9,11-12H2,(H,19,24)/p+1/t15-/m0/s1