4-chloranyl-2-methyl-N-[(E)-1-pyridin-3-ylethylideneamino]pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-2-methyl-N-[(E)-1-pyridin-3-ylethylideneamino]pyrazole-3-carboxamide Openeye Name: 4-chloro-2-methyl-N-[(E)-1-(3-pyridyl)ethylideneamino]pyrazole-3-carboxamide CAS Name: 4-chloro-2-methyl-N-[(E)-1-(3-pyridinyl)ethylideneamino]-3-pyrazolecarboxamide IUPAC Name: 4-chloro-2-methyl-N-[(E)-1-pyridin-3-ylethylideneamino]pyrazole-3-carboxamide Traditional Name: 4-chloro-2-methyl-N-[(E)-1-(3-pyridyl)ethylideneamino]pyrazole-3-carboxamide Formula: C12H12ClN5O MolecularWeight: 277.70958

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=C(C=NN1C)Cl)C2=CN=CC=C2

Isomeric SMILES

C/C(=N\NC(=O)C1=C(C=NN1C)Cl)/C2=CN=CC=C2

InChI

InChI=1S/C12H12ClN5O/c1-8(9-4-3-5-14-6-9)16-17-12(19)11-10(13)7-15-18(11)2/h3-7H,1-2H3,(H,17,19)/b16-8+