5-(azepan-1-ylsulfonyl)-1-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]indole-2,3-dione

Systemtic Name: 5-(azepan-1-ylsulfonyl)-1-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]indole-2,3-dione Openeye Name: 5-(azepan-1-ylsulfonyl)-1-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]indoline-2,3-dione CAS Name: 5-(1-azepanylsulfonyl)-1-[[4-(4-fluorophenyl)-1-piperazinyl]methyl]indole-2,3-dione IUPAC Name: 5-(azepan-1-ylsulfonyl)-1-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]indole-2,3-dione Traditional Name: 5-(azepan-1-ylsulfonyl)-1-[[4-(4-fluorophenyl)piperazino]methyl]isatin Formula: C25H29FN4O4S MolecularWeight: 500.585563

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=O)CN4CCN(CC4)C5=CC=C(C=C5)F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=O)CN4CCN(CC4)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H29FN4O4S/c26-19-5-7-20(8-6-19)28-15-13-27(14-16-28)18-30-23-10-9-21(17-22(23)24(31)25(30)32)35(33,34)29-11-3-1-2-4-12-29/h5-10,17H,1-4,11-16,18H2