N-[2-(2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]-2-methylsulfanyl-ethanamide

Systemtic Name: N-[2-(2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]-2-methylsulfanyl-ethanamide Openeye Name: N-[2-(2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]-2-methylsulfanyl-acetamide CAS Name: N-[2-(2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]-2-(methylthio)acetamide IUPAC Name: N-[2-(2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]-2-methylsulfanylacetamide Traditional Name: N-[2-(2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]-2-(methylthio)acetamide Formula: C18H28N2O2S MolecularWeight: 336.49212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CC2=CC=CC=C2O1)CCNC(=O)CSC

Isomeric SMILES

CCCCC1CN(CC2=CC=CC=C2O1)CCNC(=O)CSC

InChI

InChI=1S/C18H28N2O2S/c1-3-4-8-16-13-20(11-10-19-18(21)14-23-2)12-15-7-5-6-9-17(15)22-16/h5-7,9,16H,3-4,8,10-14H2,1-2H3,(H,19,21)