N,N-dimethyl-3-[[4-(2-methylpropyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]benzenesulfonamide

Systemtic Name: N,N-dimethyl-3-[[4-(2-methylpropyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]benzenesulfonamide Openeye Name: 3-[(4-isobutyl-5-morpholino-1,2,4-triazol-3-yl)sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide CAS Name: N,N-dimethyl-3-[[[4-(2-methylpropyl)-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]methyl]benzenesulfonamide IUPAC Name: N,N-dimethyl-3-[[4-(2-methylpropyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]benzenesulfonamide Traditional Name: 3-[[(4-isobutyl-5-morpholino-1,2,4-triazol-3-yl)thio]methyl]-N,N-dimethyl-benzenesulfonamide Formula: C19H29N5O3S2 MolecularWeight: 439.59526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1SCC2=CC(=CC=C2)S(=O)(=O)N(C)C)N3CCOCC3

Isomeric SMILES

CC(C)CN1C(=NN=C1SCC2=CC(=CC=C2)S(=O)(=O)N(C)C)N3CCOCC3

InChI

InChI=1S/C19H29N5O3S2/c1-15(2)13-24-18(23-8-10-27-11-9-23)20-21-19(24)28-14-16-6-5-7-17(12-16)29(25,26)22(3)4/h5-7,12,15H,8-11,13-14H2,1-4H3