N-tert-butyl-2-fluoranyl-5-[[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonylamino]carbamoyl]benzenesulfonamide

Systemtic Name: N-tert-butyl-2-fluoranyl-5-[[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonylamino]carbamoyl]benzenesulfonamide Openeye Name: N-tert-butyl-2-fluoro-5-[[(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)amino]carbamoyl]benzenesulfonamide CAS Name: N-tert-butyl-2-fluoro-5-[[[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-oxomethyl]hydrazo]-oxomethyl]benzenesulfonamide IUPAC Name: N-tert-butyl-2-fluoro-5-[[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)amino]carbamoyl]benzenesulfonamide Traditional Name: N-tert-butyl-2-fluoro-5-[[(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)amino]carbamoyl]benzenesulfonamide Formula: C21H26FN3O4S2 MolecularWeight: 467.577243

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=CC(=C(C=C3)F)S(=O)(=O)NC(C)(C)C

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=CC(=C(C=C3)F)S(=O)(=O)NC(C)(C)C

InChI

InChI=1S/C21H26FN3O4S2/c1-12-5-8-16-14(9-12)10-17(30-16)20(27)24-23-19(26)13-6-7-15(22)18(11-13)31(28,29)25-21(2,3)4/h6-7,10-12,25H,5,8-9H2,1-4H3,(H,23,26)(H,24,27)