N-[(1,3-dimethylpyrazol-4-yl)methyl]-N'-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]ethanediamide

Systemtic Name: N-[(1,3-dimethylpyrazol-4-yl)methyl]-N'-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]ethanediamide Openeye Name: N-[(1,3-dimethylpyrazol-4-yl)methyl]-N'-[2-(3-pyridylmethylcarbamoyl)phenyl]oxamide CAS Name: N-[(1,3-dimethyl-4-pyrazolyl)methyl]-N'-[2-[oxo-(3-pyridinylmethylamino)methyl]phenyl]oxamide IUPAC Name: N-[(1,3-dimethylpyrazol-4-yl)methyl]-N'-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]oxamide Traditional Name: N-[(1,3-dimethylpyrazol-4-yl)methyl]-N'-[2-(3-pyridylmethylcarbamoyl)phenyl]oxamide Formula: C21H22N6O3 MolecularWeight: 406.43778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CNC(=O)C(=O)NC2=CC=CC=C2C(=O)NCC3=CN=CC=C3)C

Isomeric SMILES

CC1=NN(C=C1CNC(=O)C(=O)NC2=CC=CC=C2C(=O)NCC3=CN=CC=C3)C

InChI

InChI=1S/C21H22N6O3/c1-14-16(13-27(2)26-14)12-24-20(29)21(30)25-18-8-4-3-7-17(18)19(28)23-11-15-6-5-9-22-10-15/h3-10,13H,11-12H2,1-2H3,(H,23,28)(H,24,29)(H,25,30)