1-butan-2-yl-N-methyl-N-(2-morpholin-4-yl-2-oxidanylidene-ethyl)benzotriazole-5-sulfonamide

Systemtic Name: 1-butan-2-yl-N-methyl-N-(2-morpholin-4-yl-2-oxidanylidene-ethyl)benzotriazole-5-sulfonamide Openeye Name: N-methyl-N-(2-morpholino-2-oxo-ethyl)-1-sec-butyl-benzotriazole-5-sulfonamide CAS Name: 1-butan-2-yl-N-methyl-N-[2-(4-morpholinyl)-2-oxoethyl]-5-benzotriazolesulfonamide IUPAC Name: 1-butan-2-yl-N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)benzotriazole-5-sulfonamide Traditional Name: N-(2-keto-2-morpholino-ethyl)-N-methyl-1-sec-butyl-benzotriazole-5-sulfonamide Formula: C17H25N5O4S MolecularWeight: 395.4765

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N(C)CC(=O)N3CCOCC3)N=N1

Isomeric SMILES

CCC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N(C)CC(=O)N3CCOCC3)N=N1

InChI

InChI=1S/C17H25N5O4S/c1-4-13(2)22-16-6-5-14(11-15(16)18-19-22)27(24,25)20(3)12-17(23)21-7-9-26-10-8-21/h5-6,11,13H,4,7-10,12H2,1-3H3