N-[(2S)-3-(benzotriazol-1-yl)-2-oxidanyl-propyl]-N-(4-methoxyphenyl)-4-methyl-benzenesulfonamide

Systemtic Name: N-[(2S)-3-(benzotriazol-1-yl)-2-oxidanyl-propyl]-N-(4-methoxyphenyl)-4-methyl-benzenesulfonamide Openeye Name: N-[(2S)-3-(benzotriazol-1-yl)-2-hydroxy-propyl]-N-(4-methoxyphenyl)-4-methyl-benzenesulfonamide CAS Name: N-[(2S)-3-(1-benzotriazolyl)-2-hydroxypropyl]-N-(4-methoxyphenyl)-4-methylbenzenesulfonamide IUPAC Name: N-[(2S)-3-(benzotriazol-1-yl)-2-hydroxypropyl]-N-(4-methoxyphenyl)-4-methylbenzenesulfonamide Traditional Name: N-[(2S)-3-(benzotriazol-1-yl)-2-hydroxy-propyl]-N-(4-methoxyphenyl)-4-methyl-benzenesulfonamide Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(CN2C3=CC=CC=C3N=N2)O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C[C@H](CN2C3=CC=CC=C3N=N2)O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H24N4O4S/c1-17-7-13-21(14-8-17)32(29,30)27(18-9-11-20(31-2)12-10-18)16-19(28)15-26-23-6-4-3-5-22(23)24-25-26/h3-14,19,28H,15-16H2,1-2H3/t19-/m0/s1