3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-1-(2-pyridin-2-ylcarbonylpyrazolidin-1-yl)prop-2-en-1-one

Systemtic Name: 3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-1-(2-pyridin-2-ylcarbonylpyrazolidin-1-yl)prop-2-en-1-one Openeye Name: 3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-1-[2-(pyridine-2-carbonyl)pyrazolidin-1-yl]prop-2-en-1-one CAS Name: 3-(5-chloro-1,3-dimethyl-4-pyrazolyl)-1-[2-[oxo(2-pyridinyl)methyl]-1-pyrazolidinyl]-2-propen-1-one IUPAC Name: 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-[2-(pyridine-2-carbonyl)pyrazolidin-1-yl]prop-2-en-1-one Traditional Name: 3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-1-(2-picolinoylpyrazolidin-1-yl)prop-2-en-1-one Formula: C17H18ClN5O2 MolecularWeight: 359.81012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)N2CCCN2C(=O)C3=CC=CC=N3)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C=CC(=O)N2CCCN2C(=O)C3=CC=CC=N3)Cl)C

InChI

InChI=1S/C17H18ClN5O2/c1-12-13(16(18)21(2)20-12)7-8-15(24)22-10-5-11-23(22)17(25)14-6-3-4-9-19-14/h3-4,6-9H,5,10-11H2,1-2H3