6-[(3S)-3-methylpiperidin-1-yl]sulfonyl-1-(2-phenoxyethoxy)benzotriazole

Systemtic Name: 6-[(3S)-3-methylpiperidin-1-yl]sulfonyl-1-(2-phenoxyethoxy)benzotriazole Openeye Name: 6-[[(3S)-3-methyl-1-piperidyl]sulfonyl]-1-(2-phenoxyethoxy)benzotriazole CAS Name: 6-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]-1-(2-phenoxyethoxy)benzotriazole IUPAC Name: 6-[(3S)-3-methylpiperidin-1-yl]sulfonyl-1-(2-phenoxyethoxy)benzotriazole Traditional Name: 6-[(3S)-3-methylpiperidino]sulfonyl-1-(2-phenoxyethoxy)benzotriazole Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCCOC4=CC=CC=C4

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCCOC4=CC=CC=C4

InChI

InChI=1S/C20H24N4O4S/c1-16-6-5-11-23(15-16)29(25,26)18-9-10-19-20(14-18)24(22-21-19)28-13-12-27-17-7-3-2-4-8-17/h2-4,7-10,14,16H,5-6,11-13,15H2,1H3/t16-/m0/s1