1-[2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]ethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[(2,5-dimethylphenyl)-methylsulfonyl-amino]ethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-(2,5-dimethyl-N-methylsulfonyl-anilino)acetyl]piperidine-4-carboxamide CAS Name: 1-[2-(2,5-dimethyl-N-methylsulfonylanilino)-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(2,5-dimethyl-N-methylsulfonylanilino)acetyl]piperidine-4-carboxamide Traditional Name: 1-[2-(N-mesyl-2,5-dimethyl-anilino)acetyl]isonipecotamide Formula: C17H25N3O4S MolecularWeight: 367.4631

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(CC(=O)N2CCC(CC2)C(=O)N)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(CC(=O)N2CCC(CC2)C(=O)N)S(=O)(=O)C

InChI

InChI=1S/C17H25N3O4S/c1-12-4-5-13(2)15(10-12)20(25(3,23)24)11-16(21)19-8-6-14(7-9-19)17(18)22/h4-5,10,14H,6-9,11H2,1-3H3,(H2,18,22)