N-(3-chloranyl-4-methyl-phenyl)-1-[3,5-dimethyl-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)pyrazol-4-yl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-1-[3,5-dimethyl-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)pyrazol-4-yl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-1-[3,5-dimethyl-1-(2-oxo-2-pyrrolidin-1-yl-ethyl)pyrazol-4-yl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-chloro-4-methylphenyl)-1-[[3,5-dimethyl-1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-4-pyrazolyl]sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-methylphenyl)-1-[3,5-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyrazol-4-yl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-1-[1-(2-keto-2-pyrrolidino-ethyl)-3,5-dimethyl-pyrazol-4-yl]sulfonyl-isonipecotamide Formula: C24H32ClN5O4S MolecularWeight: 522.05998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(N(N=C3C)CC(=O)N4CCCC4)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(N(N=C3C)CC(=O)N4CCCC4)C)Cl

InChI

InChI=1S/C24H32ClN5O4S/c1-16-6-7-20(14-21(16)25)26-24(32)19-8-12-29(13-9-19)35(33,34)23-17(2)27-30(18(23)3)15-22(31)28-10-4-5-11-28/h6-7,14,19H,4-5,8-13,15H2,1-3H3,(H,26,32)