2-[6-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylbenzotriazol-1-yl]oxy-N-propyl-ethanamide

Systemtic Name: 2-[6-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylbenzotriazol-1-yl]oxy-N-propyl-ethanamide Openeye Name: 2-[6-[[(3R,5R)-3,5-dimethyl-1-piperidyl]sulfonyl]benzotriazol-1-yl]oxy-N-propyl-acetamide CAS Name: 2-[[6-[[(3R,5R)-3,5-dimethyl-1-piperidinyl]sulfonyl]-1-benzotriazolyl]oxy]-N-propylacetamide IUPAC Name: 2-[6-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylbenzotriazol-1-yl]oxy-N-propylacetamide Traditional Name: 2-[6-[(3R,5R)-3,5-dimethylpiperidino]sulfonylbenzotriazol-1-yl]oxy-N-propyl-acetamide Formula: C18H27N5O4S MolecularWeight: 409.50308

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CON1C2=C(C=CC(=C2)S(=O)(=O)N3CC(CC(C3)C)C)N=N1

Isomeric SMILES

CCCNC(=O)CON1C2=C(C=CC(=C2)S(=O)(=O)N3C[C@@H](C[C@H](C3)C)C)N=N1

InChI

InChI=1S/C18H27N5O4S/c1-4-7-19-18(24)12-27-23-17-9-15(5-6-16(17)20-21-23)28(25,26)22-10-13(2)8-14(3)11-22/h5-6,9,13-14H,4,7-8,10-12H2,1-3H3,(H,19,24)/t13-,14-/m1/s1