5-bromanyl-1-[[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]methyl]indole-2,3-dione

Systemtic Name: 5-bromanyl-1-[[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]methyl]indole-2,3-dione Openeye Name: 5-bromo-1-[[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]methyl]indoline-2,3-dione CAS Name: 5-bromo-1-[[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]methyl]indole-2,3-dione IUPAC Name: 5-bromo-1-[[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]methyl]indole-2,3-dione Traditional Name: 5-bromo-1-[[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]methyl]isatin Formula: C20H19BrFN3O4S MolecularWeight: 496.349963

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)CN3C4=C(C=C(C=C4)Br)C(=O)C3=O

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)CN3C4=C(C=C(C=C4)Br)C(=O)C3=O

InChI

InChI=1S/C20H19BrFN3O4S/c21-14-2-7-18-17(12-14)19(26)20(27)25(18)13-23-8-1-9-24(11-10-23)30(28,29)16-5-3-15(22)4-6-16/h2-7,12H,1,8-11,13H2