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

Systemtic Name: 1-[4-(1,3-benzodioxol-5-yl)pyrimidin-2-yl]-N,5-dimethyl-N-(quinolin-5-ylmethyl)pyrazole-4-carboxamide Openeye Name: 1-[4-(1,3-benzodioxol-5-yl)pyrimidin-2-yl]-N,5-dimethyl-N-(5-quinolylmethyl)pyrazole-4-carboxamide CAS Name: 1-[4-(1,3-benzodioxol-5-yl)-2-pyrimidinyl]-N,5-dimethyl-N-(5-quinolinylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-[4-(1,3-benzodioxol-5-yl)pyrimidin-2-yl]-N,5-dimethyl-N-(quinolin-5-ylmethyl)pyrazole-4-carboxamide Traditional Name: 1-[4-(1,3-benzodioxol-5-yl)pyrimidin-2-yl]-N,5-dimethyl-N-(5-quinolylmethyl)pyrazole-4-carboxamide Formula: C27H22N6O3 MolecularWeight: 478.50198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NC=CC(=N2)C3=CC4=C(C=C3)OCO4)C(=O)N(C)CC5=C6C=CC=NC6=CC=C5

Isomeric SMILES

CC1=C(C=NN1C2=NC=CC(=N2)C3=CC4=C(C=C3)OCO4)C(=O)N(C)CC5=C6C=CC=NC6=CC=C5

InChI

InChI=1S/C27H22N6O3/c1-17-21(26(34)32(2)15-19-5-3-7-23-20(19)6-4-11-28-23)14-30-33(17)27-29-12-10-22(31-27)18-8-9-24-25(13-18)36-16-35-24/h3-14H,15-16H2,1-2H3