3-[(4-bromanylthiophen-2-yl)methylamino]azepan-2-one

Systemtic Name: 3-[(4-bromanylthiophen-2-yl)methylamino]azepan-2-one Openeye Name: 3-[(4-bromo-2-thienyl)methylamino]azepan-2-one CAS Name: 3-[(4-bromo-2-thiophenyl)methylamino]-2-azepanone IUPAC Name: 3-[(4-bromothiophen-2-yl)methylamino]azepan-2-one Traditional Name: 3-[(4-bromo-2-thienyl)methylamino]azepan-2-one Formula: C11H15BrN2OS MolecularWeight: 303.2186

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NCC2=CC(=CS2)Br

Isomeric SMILES

C1CCNC(=O)C(C1)NCC2=CC(=CS2)Br

InChI

InChI=1S/C11H15BrN2OS/c12-8-5-9(16-7-8)6-14-10-3-1-2-4-13-11(10)15/h5,7,10,14H,1-4,6H2,(H,13,15)