1-[(2S)-2-methylpiperidin-1-yl]-2-(6-piperidin-1-ylsulfonylbenzotriazol-1-yl)oxy-ethanone

Systemtic Name: 1-[(2S)-2-methylpiperidin-1-yl]-2-(6-piperidin-1-ylsulfonylbenzotriazol-1-yl)oxy-ethanone Openeye Name: 1-[(2S)-2-methyl-1-piperidyl]-2-[6-(1-piperidylsulfonyl)benzotriazol-1-yl]oxy-ethanone CAS Name: 1-[(2S)-2-methyl-1-piperidinyl]-2-[[6-(1-piperidinylsulfonyl)-1-benzotriazolyl]oxy]ethanone IUPAC Name: 1-[(2S)-2-methylpiperidin-1-yl]-2-(6-piperidin-1-ylsulfonylbenzotriazol-1-yl)oxyethanone Traditional Name: 1-[(2S)-2-methylpiperidino]-2-(6-piperidinosulfonylbenzotriazol-1-yl)oxy-ethanone Formula: C19H27N5O4S MolecularWeight: 421.51378

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CON2C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)N=N2

Isomeric SMILES

C[C@H]1CCCCN1C(=O)CON2C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)N=N2

InChI

InChI=1S/C19H27N5O4S/c1-15-7-3-6-12-23(15)19(25)14-28-24-18-13-16(8-9-17(18)20-21-24)29(26,27)22-10-4-2-5-11-22/h8-9,13,15H,2-7,10-12,14H2,1H3/t15-/m0/s1