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

Systemtic Name: 3-[1-(5-methylthiophen-2-yl)ethylamino]azepan-2-one Openeye Name: 3-[1-(5-methyl-2-thienyl)ethylamino]azepan-2-one CAS Name: 3-[1-(5-methyl-2-thiophenyl)ethylamino]-2-azepanone IUPAC Name: 3-[1-(5-methylthiophen-2-yl)ethylamino]azepan-2-one Traditional Name: 3-[1-(5-methyl-2-thienyl)ethylamino]azepan-2-one Formula: C13H20N2OS MolecularWeight: 252.3757

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(C)NC2CCCCNC2=O

Isomeric SMILES

CC1=CC=C(S1)C(C)NC2CCCCNC2=O

InChI

InChI=1S/C13H20N2OS/c1-9-6-7-12(17-9)10(2)15-11-5-3-4-8-14-13(11)16/h6-7,10-11,15H,3-5,8H2,1-2H3,(H,14,16)