3-chloranyl-6-fluoranyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-6-fluoranyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-6-fluoro-N-[3-(2-oxoazepan-1-yl)propyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-6-fluoro-N-[3-(2-oxo-1-azepanyl)propyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-6-fluoro-N-[3-(2-oxoazepan-1-yl)propyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-6-fluoro-N-[3-(2-ketoazepan-1-yl)propyl]benzothiophene-2-carboxamide Formula: C18H20ClFN2O2S MolecularWeight: 382.880003

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

InChI

InChI=1S/C18H20ClFN2O2S/c19-16-13-7-6-12(20)11-14(13)25-17(16)18(24)21-8-4-10-22-9-3-1-2-5-15(22)23/h6-7,11H,1-5,8-10H2,(H,21,24)