N-cyclohexyl-2-methyl-1-(3-methylsulfanylphenyl)-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide

Systemtic Name: N-cyclohexyl-2-methyl-1-(3-methylsulfanylphenyl)-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide Openeye Name: N-cyclohexyl-2-methyl-1-(3-methylsulfanylphenyl)-4-methylsulfonyl-6-oxo-piperazine-2-carboxamide CAS Name: N-cyclohexyl-2-methyl-4-methylsulfonyl-1-[3-(methylthio)phenyl]-6-oxo-2-piperazinecarboxamide IUPAC Name: N-cyclohexyl-2-methyl-1-(3-methylsulfanylphenyl)-4-methylsulfonyl-6-oxopiperazine-2-carboxamide Traditional Name: N-cyclohexyl-6-keto-4-mesyl-2-methyl-1-[3-(methylthio)phenyl]piperazine-2-carboxamide Formula: C20H29N3O4S2 MolecularWeight: 439.59196

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CC(=O)N1C2=CC(=CC=C2)SC)S(=O)(=O)C)C(=O)NC3CCCCC3

Isomeric SMILES

CC1(CN(CC(=O)N1C2=CC(=CC=C2)SC)S(=O)(=O)C)C(=O)NC3CCCCC3

InChI

InChI=1S/C20H29N3O4S2/c1-20(19(25)21-15-8-5-4-6-9-15)14-22(29(3,26)27)13-18(24)23(20)16-10-7-11-17(12-16)28-2/h7,10-12,15H,4-6,8-9,13-14H2,1-3H3,(H,21,25)