N-(2-methylpropyl)-1-(1-thiophen-2-ylsulfonylpiperidin-3-yl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(2-methylpropyl)-1-(1-thiophen-2-ylsulfonylpiperidin-3-yl)-1,2,3-triazole-4-carboxamide Openeye Name: N-isobutyl-1-[1-(2-thienylsulfonyl)-3-piperidyl]triazole-4-carboxamide CAS Name: N-(2-methylpropyl)-1-(1-thiophen-2-ylsulfonyl-3-piperidinyl)-4-triazolecarboxamide IUPAC Name: N-(2-methylpropyl)-1-(1-thiophen-2-ylsulfonylpiperidin-3-yl)triazole-4-carboxamide Traditional Name: N-isobutyl-1-[1-(2-thienylsulfonyl)-3-piperidyl]triazole-4-carboxamide Formula: C16H23N5O3S2 MolecularWeight: 397.51552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CN(N=N1)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C)CNC(=O)C1=CN(N=N1)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C16H23N5O3S2/c1-12(2)9-17-16(22)14-11-21(19-18-14)13-5-3-7-20(10-13)26(23,24)15-6-4-8-25-15/h4,6,8,11-13H,3,5,7,9-10H2,1-2H3,(H,17,22)