N-[(2S)-butan-2-yl]-2-[6-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzotriazol-1-yl]oxy-ethanamide

Systemtic Name: N-[(2S)-butan-2-yl]-2-[6-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzotriazol-1-yl]oxy-ethanamide Openeye Name: 2-[6-[[(3S)-3-methyl-1-piperidyl]sulfonyl]benzotriazol-1-yl]oxy-N-[(1S)-1-methylpropyl]acetamide CAS Name: N-[(2S)-butan-2-yl]-2-[[6-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]-1-benzotriazolyl]oxy]acetamide IUPAC Name: N-[(2S)-butan-2-yl]-2-[6-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzotriazol-1-yl]oxyacetamide Traditional Name: 2-[6-[(3S)-3-methylpiperidino]sulfonylbenzotriazol-1-yl]oxy-N-[(1S)-1-methylpropyl]acetamide Formula: C18H27N5O4S MolecularWeight: 409.50308

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CON1C2=C(C=CC(=C2)S(=O)(=O)N3CCCC(C3)C)N=N1

Isomeric SMILES

CC[C@H](C)NC(=O)CON1C2=C(C=CC(=C2)S(=O)(=O)N3CCC[C@@H](C3)C)N=N1

InChI

InChI=1S/C18H27N5O4S/c1-4-14(3)19-18(24)12-27-23-17-10-15(7-8-16(17)20-21-23)28(25,26)22-9-5-6-13(2)11-22/h7-8,10,13-14H,4-6,9,11-12H2,1-3H3,(H,19,24)/t13-,14-/m0/s1