2-[4-[[(3-cyclopropyl-1H-pyrazol-5-yl)methyl-methyl-amino]methyl]phenyl]-6-(methoxymethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[4-[[(3-cyclopropyl-1H-pyrazol-5-yl)methyl-methyl-amino]methyl]phenyl]-6-(methoxymethyl)-1H-pyrimidin-4-one Openeye Name: 2-[4-[[(3-cyclopropyl-1H-pyrazol-5-yl)methyl-methyl-amino]methyl]phenyl]-6-(methoxymethyl)-1H-pyrimidin-4-one CAS Name: 2-[4-[[(3-cyclopropyl-1H-pyrazol-5-yl)methyl-methylamino]methyl]phenyl]-6-(methoxymethyl)-1H-pyrimidin-4-one IUPAC Name: 2-[4-[[(3-cyclopropyl-1H-pyrazol-5-yl)methyl-methylamino]methyl]phenyl]-6-(methoxymethyl)-1H-pyrimidin-4-one Traditional Name: 2-[4-[[(3-cyclopropyl-1H-pyrazol-5-yl)methyl-methyl-amino]methyl]phenyl]-6-(methoxymethyl)-1H-pyrimidin-4-one Formula: C21H25N5O2 MolecularWeight: 379.4555

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C2=NC(=O)C=C(N2)COC)CC3=CC(=NN3)C4CC4

Isomeric SMILES

CN(CC1=CC=C(C=C1)C2=NC(=O)C=C(N2)COC)CC3=CC(=NN3)C4CC4

InChI

InChI=1S/C21H25N5O2/c1-26(12-17-9-19(25-24-17)15-7-8-15)11-14-3-5-16(6-4-14)21-22-18(13-28-2)10-20(27)23-21/h3-6,9-10,15H,7-8,11-13H2,1-2H3,(H,24,25)(H,22,23,27)