3-[1-(5-chloranylthiophen-2-yl)ethylamino]azepan-2-one

Systemtic Name: 3-[1-(5-chloranylthiophen-2-yl)ethylamino]azepan-2-one Openeye Name: 3-[1-(5-chloro-2-thienyl)ethylamino]azepan-2-one CAS Name: 3-[1-(5-chloro-2-thiophenyl)ethylamino]-2-azepanone IUPAC Name: 3-[1-(5-chlorothiophen-2-yl)ethylamino]azepan-2-one Traditional Name: 3-[1-(5-chloro-2-thienyl)ethylamino]azepan-2-one Formula: C12H17ClN2OS MolecularWeight: 272.79418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(S1)Cl)NC2CCCCNC2=O

Isomeric SMILES

CC(C1=CC=C(S1)Cl)NC2CCCCNC2=O

InChI

InChI=1S/C12H17ClN2OS/c1-8(10-5-6-11(13)17-10)15-9-4-2-3-7-14-12(9)16/h5-6,8-9,15H,2-4,7H2,1H3,(H,14,16)