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

Systemtic Name: 3-[(5-methylthiophen-2-yl)methylamino]azepan-2-one Openeye Name: 3-[(5-methyl-2-thienyl)methylamino]azepan-2-one CAS Name: 3-[(5-methyl-2-thiophenyl)methylamino]-2-azepanone IUPAC Name: 3-[(5-methylthiophen-2-yl)methylamino]azepan-2-one Traditional Name: 3-[(5-methyl-2-thienyl)methylamino]azepan-2-one Formula: C12H18N2OS MolecularWeight: 238.34912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CNC2CCCCNC2=O

Isomeric SMILES

CC1=CC=C(S1)CNC2CCCCNC2=O

InChI

InChI=1S/C12H18N2OS/c1-9-5-6-10(16-9)8-14-11-4-2-3-7-13-12(11)15/h5-6,11,14H,2-4,7-8H2,1H3,(H,13,15)