5-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-[(E)-pyridin-4-ylmethylideneamino]pyrazolidine-3-carboxamide

Systemtic Name: 5-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-[(E)-pyridin-4-ylmethylideneamino]pyrazolidine-3-carboxamide Openeye Name: 5-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-[(E)-4-pyridylmethyleneamino]pyrazolidine-3-carboxamide CAS Name: 5-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-N-[(E)-pyridin-4-ylmethylideneamino]-3-pyrazolidinecarboxamide IUPAC Name: 5-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-[(E)-pyridin-4-ylmethylideneamino]pyrazolidine-3-carboxamide Traditional Name: 5-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-[(E)-4-pyridylmethyleneamino]pyrazolidine-3-carboxamide Formula: C21H23N7O MolecularWeight: 389.45362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3CC(NN3)C(=O)NN=CC4=CC=NC=C4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C3CC(NN3)C(=O)N/N=C/C4=CC=NC=C4

InChI

InChI=1S/C21H23N7O/c1-14-20(15(2)28(27-14)17-6-4-3-5-7-17)18-12-19(25-24-18)21(29)26-23-13-16-8-10-22-11-9-16/h3-11,13,18-19,24-25H,12H2,1-2H3,(H,26,29)/b23-13+