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

Systemtic Name: 1,2-dimethyl-N-[2-[(4-methylsulfanylphenyl)methylamino]-2-oxidanylidene-ethyl]-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide Openeye Name: 1,2-dimethyl-N-[2-[(4-methylsulfanylphenyl)methylamino]-2-oxo-ethyl]-4-methylsulfonyl-6-oxo-piperazine-2-carboxamide CAS Name: 1,2-dimethyl-4-methylsulfonyl-N-[2-[[4-(methylthio)phenyl]methylamino]-2-oxoethyl]-6-oxo-2-piperazinecarboxamide IUPAC Name: 1,2-dimethyl-N-[2-[(4-methylsulfanylphenyl)methylamino]-2-oxoethyl]-4-methylsulfonyl-6-oxopiperazine-2-carboxamide Traditional Name: 6-keto-N-[2-keto-2-[[4-(methylthio)benzyl]amino]ethyl]-4-mesyl-1,2-dimethyl-piperazine-2-carboxamide Formula: C18H26N4O5S2 MolecularWeight: 442.55284

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CC(=O)N1C)S(=O)(=O)C)C(=O)NCC(=O)NCC2=CC=C(C=C2)SC

Isomeric SMILES

CC1(CN(CC(=O)N1C)S(=O)(=O)C)C(=O)NCC(=O)NCC2=CC=C(C=C2)SC

InChI

InChI=1S/C18H26N4O5S2/c1-18(12-22(29(4,26)27)11-16(24)21(18)2)17(25)20-10-15(23)19-9-13-5-7-14(28-3)8-6-13/h5-8H,9-12H2,1-4H3,(H,19,23)(H,20,25)