N,N-dimethyl-3-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethoxy]benzotriazole-5-sulfonamide

Systemtic Name: N,N-dimethyl-3-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethoxy]benzotriazole-5-sulfonamide Openeye Name: N,N-dimethyl-3-[2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethoxy]benzotriazole-5-sulfonamide CAS Name: N,N-dimethyl-3-[2-[(2S)-2-methyl-1-piperidinyl]-2-oxoethoxy]-5-benzotriazolesulfonamide IUPAC Name: N,N-dimethyl-3-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethoxy]benzotriazole-5-sulfonamide Traditional Name: 3-[2-keto-2-[(2S)-2-methylpiperidino]ethoxy]-N,N-dimethyl-benzotriazole-5-sulfonamide Formula: C16H23N5O4S MolecularWeight: 381.44992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N5O4S/c1-12-6-4-5-9-20(12)16(22)11-25-21-15-10-13(26(23,24)19(2)3)7-8-14(15)17-18-21/h7-8,10,12H,4-6,9,11H2,1-3H3/t12-/m0/s1