3-[(2-methyl-1-thiophen-2-yl-propyl)amino]azepan-2-one

Systemtic Name: 3-[(2-methyl-1-thiophen-2-yl-propyl)amino]azepan-2-one Openeye Name: 3-[[2-methyl-1-(2-thienyl)propyl]amino]azepan-2-one CAS Name: 3-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-azepanone IUPAC Name: 3-[(2-methyl-1-thiophen-2-ylpropyl)amino]azepan-2-one Traditional Name: 3-[[2-methyl-1-(2-thienyl)propyl]amino]azepan-2-one Formula: C14H22N2OS MolecularWeight: 266.40228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CS1)NC2CCCCNC2=O

Isomeric SMILES

CC(C)C(C1=CC=CS1)NC2CCCCNC2=O

InChI

InChI=1S/C14H22N2OS/c1-10(2)13(12-7-5-9-18-12)16-11-6-3-4-8-15-14(11)17/h5,7,9-11,13,16H,3-4,6,8H2,1-2H3,(H,15,17)