1-[4-(1,3-benzodioxol-5-yl)pyrimidin-2-yl]-N,5-dimethyl-N-phenethyl-pyrazole-4-carboxamide

Systemtic Name: 1-[4-(1,3-benzodioxol-5-yl)pyrimidin-2-yl]-N,5-dimethyl-N-phenethyl-pyrazole-4-carboxamide Openeye Name: 1-[4-(1,3-benzodioxol-5-yl)pyrimidin-2-yl]-N,5-dimethyl-N-phenethyl-pyrazole-4-carboxamide CAS Name: 1-[4-(1,3-benzodioxol-5-yl)-2-pyrimidinyl]-N,5-dimethyl-N-phenethyl-4-pyrazolecarboxamide IUPAC Name: 1-[4-(1,3-benzodioxol-5-yl)pyrimidin-2-yl]-N,5-dimethyl-N-phenethylpyrazole-4-carboxamide Traditional Name: 1-[4-(1,3-benzodioxol-5-yl)pyrimidin-2-yl]-N,5-dimethyl-N-phenethyl-pyrazole-4-carboxamide Formula: C25H23N5O3 MolecularWeight: 441.48182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NC=CC(=N2)C3=CC4=C(C=C3)OCO4)C(=O)N(C)CCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C=NN1C2=NC=CC(=N2)C3=CC4=C(C=C3)OCO4)C(=O)N(C)CCC5=CC=CC=C5

InChI

InChI=1S/C25H23N5O3/c1-17-20(24(31)29(2)13-11-18-6-4-3-5-7-18)15-27-30(17)25-26-12-10-21(28-25)19-8-9-22-23(14-19)33-16-32-22/h3-10,12,14-15H,11,13,16H2,1-2H3