N-(isoquinolin-5-ylmethyl)-5-[(3-methoxyphenoxy)methyl]-N-methyl-1H-pyrazole-3-carboxamide

Systemtic Name: N-(isoquinolin-5-ylmethyl)-5-[(3-methoxyphenoxy)methyl]-N-methyl-1H-pyrazole-3-carboxamide Openeye Name: N-(5-isoquinolylmethyl)-5-[(3-methoxyphenoxy)methyl]-N-methyl-1H-pyrazole-3-carboxamide CAS Name: N-(5-isoquinolinylmethyl)-5-[(3-methoxyphenoxy)methyl]-N-methyl-1H-pyrazole-3-carboxamide IUPAC Name: N-(isoquinolin-5-ylmethyl)-5-[(3-methoxyphenoxy)methyl]-N-methyl-1H-pyrazole-3-carboxamide Traditional Name: N-(5-isoquinolylmethyl)-5-[(3-methoxyphenoxy)methyl]-N-methyl-1H-pyrazole-3-carboxamide Formula: C23H22N4O3 MolecularWeight: 402.44578

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC2=C1C=CN=C2)C(=O)C3=NNC(=C3)COC4=CC=CC(=C4)OC

Isomeric SMILES

CN(CC1=CC=CC2=C1C=CN=C2)C(=O)C3=NNC(=C3)COC4=CC=CC(=C4)OC

InChI

InChI=1S/C23H22N4O3/c1-27(14-17-6-3-5-16-13-24-10-9-21(16)17)23(28)22-11-18(25-26-22)15-30-20-8-4-7-19(12-20)29-2/h3-13H,14-15H2,1-2H3,(H,25,26)