1-[4-(1,3-benzodioxol-5-yl)pyrimidin-2-yl]-5-methyl-N,N-bis(prop-2-enyl)pyrazole-4-carboxamide

Systemtic Name: 1-[4-(1,3-benzodioxol-5-yl)pyrimidin-2-yl]-5-methyl-N,N-bis(prop-2-enyl)pyrazole-4-carboxamide Openeye Name: N,N-diallyl-1-[4-(1,3-benzodioxol-5-yl)pyrimidin-2-yl]-5-methyl-pyrazole-4-carboxamide CAS Name: 1-[4-(1,3-benzodioxol-5-yl)-2-pyrimidinyl]-5-methyl-N,N-bis(prop-2-enyl)-4-pyrazolecarboxamide IUPAC Name: 1-[4-(1,3-benzodioxol-5-yl)pyrimidin-2-yl]-5-methyl-N,N-bis(prop-2-enyl)pyrazole-4-carboxamide Traditional Name: N,N-diallyl-1-[4-(1,3-benzodioxol-5-yl)pyrimidin-2-yl]-5-methyl-pyrazole-4-carboxamide Formula: C22H21N5O3 MolecularWeight: 403.43384

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(CC=C)CC=C

Isomeric SMILES

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

InChI

InChI=1S/C22H21N5O3/c1-4-10-26(11-5-2)21(28)17-13-24-27(15(17)3)22-23-9-8-18(25-22)16-6-7-19-20(12-16)30-14-29-19/h4-9,12-13H,1-2,10-11,14H2,3H3