1,2-dimethyl-4-methylsulfonyl-6-oxidanylidene-N-[2-oxidanylidene-2-(3-propylsulfanylpropylamino)ethyl]piperazine-2-carboxamide

Systemtic Name: 1,2-dimethyl-4-methylsulfonyl-6-oxidanylidene-N-[2-oxidanylidene-2-(3-propylsulfanylpropylamino)ethyl]piperazine-2-carboxamide Openeye Name: 1,2-dimethyl-4-methylsulfonyl-6-oxo-N-[2-oxo-2-(3-propylsulfanylpropylamino)ethyl]piperazine-2-carboxamide CAS Name: 1,2-dimethyl-4-methylsulfonyl-6-oxo-N-[2-oxo-2-[3-(propylthio)propylamino]ethyl]-2-piperazinecarboxamide IUPAC Name: 1,2-dimethyl-4-methylsulfonyl-6-oxo-N-[2-oxo-2-(3-propylsulfanylpropylamino)ethyl]piperazine-2-carboxamide Traditional Name: 6-keto-N-[2-keto-2-[3-(propylthio)propylamino]ethyl]-4-mesyl-1,2-dimethyl-piperazine-2-carboxamide Formula: C16H30N4O5S2 MolecularWeight: 422.5632

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Descriptors Computed from Structure

Canonical SMILES:

CCCSCCCNC(=O)CNC(=O)C1(CN(CC(=O)N1C)S(=O)(=O)C)C

Isomeric SMILES

CCCSCCCNC(=O)CNC(=O)C1(CN(CC(=O)N1C)S(=O)(=O)C)C

InChI

InChI=1S/C16H30N4O5S2/c1-5-8-26-9-6-7-17-13(21)10-18-15(23)16(2)12-20(27(4,24)25)11-14(22)19(16)3/h5-12H2,1-4H3,(H,17,21)(H,18,23)