4-(azepan-1-ylsulfonyl)-N-[2-(dimethylamino)-2-oxidanylidene-ethyl]-N-methyl-benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[2-(dimethylamino)-2-oxidanylidene-ethyl]-N-methyl-benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-[2-(dimethylamino)-2-oxo-ethyl]-N-methyl-benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-[2-(dimethylamino)-2-oxoethyl]-N-methylbenzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-[2-(dimethylamino)-2-oxoethyl]-N-methylbenzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-[2-(dimethylamino)-2-keto-ethyl]-N-methyl-benzamide Formula: C18H27N3O4S MolecularWeight: 381.48968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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