3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonyl-N-(1H-1,2,4-triazol-5-yl)benzamide

Systemtic Name: 3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonyl-N-(1H-1,2,4-triazol-5-yl)benzamide Openeye Name: 3-[[(3R,5R)-3,5-dimethyl-1-piperidyl]sulfonyl]-N-(1H-1,2,4-triazol-5-yl)benzamide CAS Name: 3-[[(3R,5R)-3,5-dimethyl-1-piperidinyl]sulfonyl]-N-(1H-1,2,4-triazol-5-yl)benzamide IUPAC Name: 3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonyl-N-(1H-1,2,4-triazol-5-yl)benzamide Traditional Name: 3-[(3R,5R)-3,5-dimethylpiperidino]sulfonyl-N-(1H-1,2,4-triazol-5-yl)benzamide Formula: C16H21N5O3S MolecularWeight: 363.43464

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=NC=NN3)C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=NC=NN3)C

InChI

InChI=1S/C16H21N5O3S/c1-11-6-12(2)9-21(8-11)25(23,24)14-5-3-4-13(7-14)15(22)19-16-17-10-18-20-16/h3-5,7,10-12H,6,8-9H2,1-2H3,(H2,17,18,19,20,22)/t11-,12-/m1/s1