1-[2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]propanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]propanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-(5-chloro-2-methyl-N-methylsulfonyl-anilino)propanoyl]piperidine-4-carboxamide CAS Name: 1-[2-(5-chloro-2-methyl-N-methylsulfonylanilino)-1-oxopropyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(5-chloro-2-methyl-N-methylsulfonylanilino)propanoyl]piperidine-4-carboxamide Traditional Name: 1-[2-(5-chloro-N-mesyl-2-methyl-anilino)propanoyl]isonipecotamide Formula: C17H24ClN3O4S MolecularWeight: 401.90816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24ClN3O4S/c1-11-4-5-14(18)10-15(11)21(26(3,24)25)12(2)17(23)20-8-6-13(7-9-20)16(19)22/h4-5,10,12-13H,6-9H2,1-3H3,(H2,19,22)