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

Systemtic Name: N-cyclopentyl-2-methyl-1-(3-methylsulfanylphenyl)-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide Openeye Name: N-cyclopentyl-2-methyl-1-(3-methylsulfanylphenyl)-4-methylsulfonyl-6-oxo-piperazine-2-carboxamide CAS Name: N-cyclopentyl-2-methyl-4-methylsulfonyl-1-[3-(methylthio)phenyl]-6-oxo-2-piperazinecarboxamide IUPAC Name: N-cyclopentyl-2-methyl-1-(3-methylsulfanylphenyl)-4-methylsulfonyl-6-oxopiperazine-2-carboxamide Traditional Name: N-cyclopentyl-6-keto-4-mesyl-2-methyl-1-[3-(methylthio)phenyl]piperazine-2-carboxamide Formula: C19H27N3O4S2 MolecularWeight: 425.56538

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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)NC3CCCC3

Isomeric SMILES

CC1(CN(CC(=O)N1C2=CC(=CC=C2)SC)S(=O)(=O)C)C(=O)NC3CCCC3

InChI

InChI=1S/C19H27N3O4S2/c1-19(18(24)20-14-7-4-5-8-14)13-21(28(3,25)26)12-17(23)22(19)15-9-6-10-16(11-15)27-2/h6,9-11,14H,4-5,7-8,12-13H2,1-3H3,(H,20,24)