N-[[1-(dimethylamino)cycloheptyl]methyl]-2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide

Systemtic Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-2-[2-(dimethylamino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-2-[[2-(dimethylamino)-2-oxoethyl]thio]benzamide IUPAC Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-2-[2-(dimethylamino)-2-oxoethyl]sulfanylbenzamide Traditional Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-2-[[2-(dimethylamino)-2-keto-ethyl]thio]benzamide Formula: C21H33N3O2S MolecularWeight: 391.57062

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CSC1=CC=CC=C1C(=O)NCC2(CCCCCC2)N(C)C

Isomeric SMILES

CN(C)C(=O)CSC1=CC=CC=C1C(=O)NCC2(CCCCCC2)N(C)C

InChI

InChI=1S/C21H33N3O2S/c1-23(2)19(25)15-27-18-12-8-7-11-17(18)20(26)22-16-21(24(3)4)13-9-5-6-10-14-21/h7-8,11-12H,5-6,9-10,13-16H2,1-4H3,(H,22,26)