N,N-dimethyl-2-[4-(2-methyl-5-methylsulfanyl-phenyl)carbonyl-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N,N-dimethyl-2-[4-(2-methyl-5-methylsulfanyl-phenyl)carbonyl-1,4-diazepan-1-yl]ethanamide Openeye Name: N,N-dimethyl-2-[4-(2-methyl-5-methylsulfanyl-benzoyl)-1,4-diazepan-1-yl]acetamide CAS Name: N,N-dimethyl-2-[4-[[2-methyl-5-(methylthio)phenyl]-oxomethyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N,N-dimethyl-2-[4-(2-methyl-5-methylsulfanylbenzoyl)-1,4-diazepan-1-yl]acetamide Traditional Name: N,N-dimethyl-2-[4-[2-methyl-5-(methylthio)benzoyl]-1,4-diazepan-1-yl]acetamide Formula: C18H27N3O2S MolecularWeight: 349.49088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC)C(=O)N2CCCN(CC2)CC(=O)N(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC)C(=O)N2CCCN(CC2)CC(=O)N(C)C

InChI

InChI=1S/C18H27N3O2S/c1-14-6-7-15(24-4)12-16(14)18(23)21-9-5-8-20(10-11-21)13-17(22)19(2)3/h6-7,12H,5,8-11,13H2,1-4H3