5-bromanyl-1-cyclopropylcarbonyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2,3-dihydroindole-7-sulfonamide

Systemtic Name: 5-bromanyl-1-cyclopropylcarbonyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2,3-dihydroindole-7-sulfonamide Openeye Name: 5-bromo-1-(cyclopropanecarbonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)indoline-7-sulfonamide CAS Name: 5-bromo-1-[cyclopropyl(oxo)methyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2,3-dihydroindole-7-sulfonamide IUPAC Name: 5-bromo-1-(cyclopropanecarbonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2,3-dihydroindole-7-sulfonamide Traditional Name: 5-bromo-1-(cyclopropanecarbonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)indoline-7-sulfonamide Formula: C21H20BrN3O4S2 MolecularWeight: 522.4352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=C4C(=CC(=C3)Br)CCN4C(=O)C5CC5

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=C4C(=CC(=C3)Br)CCN4C(=O)C5CC5

InChI

InChI=1S/C21H20BrN3O4S2/c1-2-29-15-5-6-16-17(11-15)30-21(23-16)24-31(27,28)18-10-14(22)9-13-7-8-25(19(13)18)20(26)12-3-4-12/h5-6,9-12H,2-4,7-8H2,1H3,(H,23,24)