3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[3-(diethylsulfamoyl)phenyl]propanamide

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[3-(diethylsulfamoyl)phenyl]propanamide Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[3-(diethylsulfamoyl)phenyl]propanamide CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-N-[3-(diethylsulfamoyl)phenyl]propanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-[3-(diethylsulfamoyl)phenyl]propanamide Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[3-(diethylsulfamoyl)phenyl]propionamide Formula: C21H29N5O3S MolecularWeight: 431.55166

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)NC(=O)CCC2=C(N(N=C2C)CCC#N)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)NC(=O)CCC2=C(N(N=C2C)CCC#N)C

InChI

InChI=1S/C21H29N5O3S/c1-5-25(6-2)30(28,29)19-10-7-9-18(15-19)23-21(27)12-11-20-16(3)24-26(17(20)4)14-8-13-22/h7,9-10,15H,5-6,8,11-12,14H2,1-4H3,(H,23,27)