5-chloranyl-3-methyl-1-(2-methylpropyl)-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-4-yl]pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-1-(2-methylpropyl)-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-4-yl]pyrazole-4-carboxamide Openeye Name: N-[1-(2-anilino-2-oxo-ethyl)-4-piperidyl]-5-chloro-1-isobutyl-3-methyl-pyrazole-4-carboxamide CAS Name: N-[1-(2-anilino-2-oxoethyl)-4-piperidinyl]-5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolecarboxamide IUPAC Name: N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-5-chloro-3-methyl-1-(2-methylpropyl)pyrazole-4-carboxamide Traditional Name: N-[1-(2-anilino-2-keto-ethyl)-4-piperidyl]-5-chloro-1-isobutyl-3-methyl-pyrazole-4-carboxamide Formula: C22H30ClN5O2 MolecularWeight: 431.9589

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2CCN(CC2)CC(=O)NC3=CC=CC=C3)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2CCN(CC2)CC(=O)NC3=CC=CC=C3)Cl)CC(C)C

InChI

InChI=1S/C22H30ClN5O2/c1-15(2)13-28-21(23)20(16(3)26-28)22(30)25-18-9-11-27(12-10-18)14-19(29)24-17-7-5-4-6-8-17/h4-8,15,18H,9-14H2,1-3H3,(H,24,29)(H,25,30)