N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-2-chloranyl-4-fluoranyl-benzamide

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-2-chloranyl-4-fluoranyl-benzamide Openeye Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-2-chloro-4-fluoro-benzamide CAS Name: N-[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]-2-chloro-4-fluorobenzamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-2-chloro-4-fluorobenzamide Traditional Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-2-chloro-4-fluoro-benzamide Formula: C19H22ClFN2OS MolecularWeight: 380.907183

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(CNC(=O)C2=C(C=C(C=C2)F)Cl)C3=CSC=C3

Isomeric SMILES

C1CCCN(CC1)C(CNC(=O)C2=C(C=C(C=C2)F)Cl)C3=CSC=C3

InChI

InChI=1S/C19H22ClFN2OS/c20-17-11-15(21)5-6-16(17)19(24)22-12-18(14-7-10-25-13-14)23-8-3-1-2-4-9-23/h5-7,10-11,13,18H,1-4,8-9,12H2,(H,22,24)