4-[[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-methylsulfonyl-amino]-N,N-dimethyl-benzamide

Systemtic Name: 4-[[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-methylsulfonyl-amino]-N,N-dimethyl-benzamide Openeye Name: 4-[[2-(azepan-1-yl)-2-oxo-ethyl]-methylsulfonyl-amino]-N,N-dimethyl-benzamide CAS Name: 4-[[2-(1-azepanyl)-2-oxoethyl]-methylsulfonylamino]-N,N-dimethylbenzamide IUPAC Name: 4-[[2-(azepan-1-yl)-2-oxoethyl]-methylsulfonylamino]-N,N-dimethylbenzamide Traditional Name: 4-[[2-(azepan-1-yl)-2-keto-ethyl]-mesyl-amino]-N,N-dimethyl-benzamide Formula: C18H27N3O4S MolecularWeight: 381.48968

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=C(C=C1)N(CC(=O)N2CCCCCC2)S(=O)(=O)C

Isomeric SMILES

CN(C)C(=O)C1=CC=C(C=C1)N(CC(=O)N2CCCCCC2)S(=O)(=O)C

InChI

InChI=1S/C18H27N3O4S/c1-19(2)18(23)15-8-10-16(11-9-15)21(26(3,24)25)14-17(22)20-12-6-4-5-7-13-20/h8-11H,4-7,12-14H2,1-3H3