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

Systemtic Name: 4-[[[(5R)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonylamino]carbamoyl]-N-methyl-benzenesulfonamide Openeye Name: 4-[[[(5R)-5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]amino]carbamoyl]-N-methyl-benzenesulfonamide CAS Name: 4-[[[[(5R)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-oxomethyl]hydrazo]-oxomethyl]-N-methylbenzenesulfonamide IUPAC Name: 4-[[[(5R)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl]amino]carbamoyl]-N-methylbenzenesulfonamide Traditional Name: 4-[[[(5R)-5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]amino]carbamoyl]-N-methyl-benzenesulfonamide Formula: C21H27N3O4S2 MolecularWeight: 449.58678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=CC=C(C=C3)S(=O)(=O)NC

Isomeric SMILES

CC(C)(C)[C@@H]1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=CC=C(C=C3)S(=O)(=O)NC

InChI

InChI=1S/C21H27N3O4S2/c1-21(2,3)15-7-10-17-14(11-15)12-18(29-17)20(26)24-23-19(25)13-5-8-16(9-6-13)30(27,28)22-4/h5-6,8-9,12,15,22H,7,10-11H2,1-4H3,(H,23,25)(H,24,26)/t15-/m1/s1