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

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[3-(phenylcarbamoylamino)phenyl]propanamide Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[3-(phenylcarbamoylamino)phenyl]propanamide CAS Name: N-[3-[[anilino(oxo)methyl]amino]phenyl]-3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]propanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-[3-(phenylcarbamoylamino)phenyl]propanamide Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[3-(phenylcarbamoylamino)phenyl]propionamide Formula: C24H26N6O2 MolecularWeight: 430.50224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)NC2=CC(=CC=C2)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)NC2=CC(=CC=C2)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C24H26N6O2/c1-17-22(18(2)30(29-17)15-7-14-25)12-13-23(31)26-20-10-6-11-21(16-20)28-24(32)27-19-8-4-3-5-9-19/h3-6,8-11,16H,7,12-13,15H2,1-2H3,(H,26,31)(H2,27,28,32)