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

Systemtic Name: 1,2-dimethyl-N-[2-[2-(3-methylphenyl)ethylamino]-2-oxidanylidene-ethyl]-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide Openeye Name: 1,2-dimethyl-4-methylsulfonyl-N-[2-[2-(m-tolyl)ethylamino]-2-oxo-ethyl]-6-oxo-piperazine-2-carboxamide CAS Name: 1,2-dimethyl-N-[2-[2-(3-methylphenyl)ethylamino]-2-oxoethyl]-4-methylsulfonyl-6-oxo-2-piperazinecarboxamide IUPAC Name: 1,2-dimethyl-N-[2-[2-(3-methylphenyl)ethylamino]-2-oxoethyl]-4-methylsulfonyl-6-oxopiperazine-2-carboxamide Traditional Name: 6-keto-N-[2-keto-2-[2-(m-tolyl)ethylamino]ethyl]-4-mesyl-1,2-dimethyl-piperazine-2-carboxamide Formula: C19H28N4O5S MolecularWeight: 424.51442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCNC(=O)CNC(=O)C2(CN(CC(=O)N2C)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=CC=C1)CCNC(=O)CNC(=O)C2(CN(CC(=O)N2C)S(=O)(=O)C)C

InChI

InChI=1S/C19H28N4O5S/c1-14-6-5-7-15(10-14)8-9-20-16(24)11-21-18(26)19(2)13-23(29(4,27)28)12-17(25)22(19)3/h5-7,10H,8-9,11-13H2,1-4H3,(H,20,24)(H,21,26)