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

Systemtic Name: 1,2-dimethyl-N-[2-[2-(4-methylsulfanylphenyl)ethylamino]-2-oxidanylidene-ethyl]-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide Openeye Name: 1,2-dimethyl-N-[2-[2-(4-methylsulfanylphenyl)ethylamino]-2-oxo-ethyl]-4-methylsulfonyl-6-oxo-piperazine-2-carboxamide CAS Name: 1,2-dimethyl-4-methylsulfonyl-N-[2-[2-[4-(methylthio)phenyl]ethylamino]-2-oxoethyl]-6-oxo-2-piperazinecarboxamide IUPAC Name: 1,2-dimethyl-N-[2-[2-(4-methylsulfanylphenyl)ethylamino]-2-oxoethyl]-4-methylsulfonyl-6-oxopiperazine-2-carboxamide Traditional Name: 6-keto-N-[2-keto-2-[2-[4-(methylthio)phenyl]ethylamino]ethyl]-4-mesyl-1,2-dimethyl-piperazine-2-carboxamide Formula: C19H28N4O5S2 MolecularWeight: 456.57942

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CC(=O)N1C)S(=O)(=O)C)C(=O)NCC(=O)NCCC2=CC=C(C=C2)SC

Isomeric SMILES

CC1(CN(CC(=O)N1C)S(=O)(=O)C)C(=O)NCC(=O)NCCC2=CC=C(C=C2)SC

InChI

InChI=1S/C19H28N4O5S2/c1-19(13-23(30(4,27)28)12-17(25)22(19)2)18(26)21-11-16(24)20-10-9-14-5-7-15(29-3)8-6-14/h5-8H,9-13H2,1-4H3,(H,20,24)(H,21,26)