2-[6-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzotriazol-1-yl]oxy-N-[(2S)-4-phenylbutan-2-yl]ethanamide

Systemtic Name: 2-[6-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzotriazol-1-yl]oxy-N-[(2S)-4-phenylbutan-2-yl]ethanamide Openeye Name: N-[(1S)-1-methyl-3-phenyl-propyl]-2-[6-[[(3S)-3-methyl-1-piperidyl]sulfonyl]benzotriazol-1-yl]oxy-acetamide CAS Name: 2-[[6-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]-1-benzotriazolyl]oxy]-N-[(2S)-4-phenylbutan-2-yl]acetamide IUPAC Name: 2-[6-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzotriazol-1-yl]oxy-N-[(2S)-4-phenylbutan-2-yl]acetamide Traditional Name: N-[(1S)-1-methyl-3-phenyl-propyl]-2-[6-[(3S)-3-methylpiperidino]sulfonylbenzotriazol-1-yl]oxy-acetamide Formula: C24H31N5O4S MolecularWeight: 485.59904

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCC(=O)NC(C)CCC4=CC=CC=C4

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCC(=O)N[C@@H](C)CCC4=CC=CC=C4

InChI

InChI=1S/C24H31N5O4S/c1-18-7-6-14-28(16-18)34(31,32)21-12-13-22-23(15-21)29(27-26-22)33-17-24(30)25-19(2)10-11-20-8-4-3-5-9-20/h3-5,8-9,12-13,15,18-19H,6-7,10-11,14,16-17H2,1-2H3,(H,25,30)/t18-,19-/m0/s1