5-chloranyl-3-methyl-1-phenyl-N-(6-piperidin-1-ylpyridin-3-yl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-1-phenyl-N-(6-piperidin-1-ylpyridin-3-yl)pyrazole-4-carboxamide Openeye Name: 5-chloro-3-methyl-1-phenyl-N-[6-(1-piperidyl)-3-pyridyl]pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-1-phenyl-N-[6-(1-piperidinyl)-3-pyridinyl]-4-pyrazolecarboxamide IUPAC Name: 5-chloro-3-methyl-1-phenyl-N-(6-piperidin-1-ylpyridin-3-yl)pyrazole-4-carboxamide Traditional Name: 5-chloro-3-methyl-1-phenyl-N-(6-piperidino-3-pyridyl)pyrazole-4-carboxamide Formula: C21H22ClN5O MolecularWeight: 395.88528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CN=C(C=C2)N3CCCCC3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CN=C(C=C2)N3CCCCC3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C21H22ClN5O/c1-15-19(20(22)27(25-15)17-8-4-2-5-9-17)21(28)24-16-10-11-18(23-14-16)26-12-6-3-7-13-26/h2,4-5,8-11,14H,3,6-7,12-13H2,1H3,(H,24,28)