4-[[2-[3-(4-chlorophenyl)sulfanylpropylamino]-2-oxidanylidene-ethyl]-methylsulfonyl-amino]-N,N-dimethyl-benzamide

Systemtic Name: 4-[[2-[3-(4-chlorophenyl)sulfanylpropylamino]-2-oxidanylidene-ethyl]-methylsulfonyl-amino]-N,N-dimethyl-benzamide Openeye Name: 4-[[2-[3-(4-chlorophenyl)sulfanylpropylamino]-2-oxo-ethyl]-methylsulfonyl-amino]-N,N-dimethyl-benzamide CAS Name: 4-[[2-[3-[(4-chlorophenyl)thio]propylamino]-2-oxoethyl]-methylsulfonylamino]-N,N-dimethylbenzamide IUPAC Name: 4-[[2-[3-(4-chlorophenyl)sulfanylpropylamino]-2-oxoethyl]-methylsulfonylamino]-N,N-dimethylbenzamide Traditional Name: 4-[[2-[3-[(4-chlorophenyl)thio]propylamino]-2-keto-ethyl]-mesyl-amino]-N,N-dimethyl-benzamide Formula: C21H26ClN3O4S2 MolecularWeight: 484.03184

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=C(C=C1)N(CC(=O)NCCCSC2=CC=C(C=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CN(C)C(=O)C1=CC=C(C=C1)N(CC(=O)NCCCSC2=CC=C(C=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C21H26ClN3O4S2/c1-24(2)21(27)16-5-9-18(10-6-16)25(31(3,28)29)15-20(26)23-13-4-14-30-19-11-7-17(22)8-12-19/h5-12H,4,13-15H2,1-3H3,(H,23,26)