1-[1-(3,4-dimethoxyphenyl)sulfonylpiperidin-3-yl]-N-(2-methylpropyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-[1-(3,4-dimethoxyphenyl)sulfonylpiperidin-3-yl]-N-(2-methylpropyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-[1-(3,4-dimethoxyphenyl)sulfonyl-3-piperidyl]-N-isobutyl-triazole-4-carboxamide CAS Name: 1-[1-(3,4-dimethoxyphenyl)sulfonyl-3-piperidinyl]-N-(2-methylpropyl)-4-triazolecarboxamide IUPAC Name: 1-[1-(3,4-dimethoxyphenyl)sulfonylpiperidin-3-yl]-N-(2-methylpropyl)triazole-4-carboxamide Traditional Name: 1-[1-(3,4-dimethoxyphenyl)sulfonyl-3-piperidyl]-N-isobutyl-triazole-4-carboxamide Formula: C20H29N5O5S MolecularWeight: 451.53976

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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(=C(C=C3)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C20H29N5O5S/c1-14(2)11-21-20(26)17-13-25(23-22-17)15-6-5-9-24(12-15)31(27,28)16-7-8-18(29-3)19(10-16)30-4/h7-8,10,13-15H,5-6,9,11-12H2,1-4H3,(H,21,26)