N-(4-bromanyl-2-fluoranyl-phenyl)-2-(5-methylthiophen-2-yl)azepane-1-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-(5-methylthiophen-2-yl)azepane-1-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-(5-methyl-2-thienyl)azepane-1-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-(5-methyl-2-thiophenyl)-1-azepanecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-(5-methylthiophen-2-yl)azepane-1-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-(5-methyl-2-thienyl)azepane-1-carboxamide Formula: C18H20BrFN2OS MolecularWeight: 411.331603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2CCCCCN2C(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CC1=CC=C(S1)C2CCCCCN2C(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C18H20BrFN2OS/c1-12-6-9-17(24-12)16-5-3-2-4-10-22(16)18(23)21-15-8-7-13(19)11-14(15)20/h6-9,11,16H,2-5,10H2,1H3,(H,21,23)