N-[3-[4-(2-methylpropyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]propyl]-2-oxidanylidene-3,4-dihydro-1H-quinoline-6-sulfonamide

Systemtic Name: N-[3-[4-(2-methylpropyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]propyl]-2-oxidanylidene-3,4-dihydro-1H-quinoline-6-sulfonamide Openeye Name: N-[3-(4-isobutyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide CAS Name: N-[3-[4-(2-methylpropyl)-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide IUPAC Name: N-[3-[4-(2-methylpropyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]propyl]-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide Traditional Name: N-[3-[4-isobutyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-2-keto-3,4-dihydro-1H-quinoline-6-sulfonamide Formula: C19H27N5O3S2 MolecularWeight: 437.57938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1SC)CCCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CC3

Isomeric SMILES

CC(C)CN1C(=NN=C1SC)CCCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CC3

InChI

InChI=1S/C19H27N5O3S2/c1-13(2)12-24-17(22-23-19(24)28-3)5-4-10-20-29(26,27)15-7-8-16-14(11-15)6-9-18(25)21-16/h7-8,11,13,20H,4-6,9-10,12H2,1-3H3,(H,21,25)