(E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-N-[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]prop-2-enamide

Systemtic Name: (E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-N-[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]prop-2-enamide Openeye Name: (E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-N-[2-(2-furyl)-2-(1-piperidyl)ethyl]prop-2-enamide CAS Name: (E)-3-(1-butyl-5-chloro-3-methyl-4-pyrazolyl)-N-[2-(2-furanyl)-2-(1-piperidinyl)ethyl]-2-propenamide IUPAC Name: (E)-3-(1-butyl-5-chloro-3-methylpyrazol-4-yl)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]prop-2-enamide Traditional Name: (E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-N-[2-(2-furyl)-2-piperidino-ethyl]acrylamide Formula: C22H31ClN4O2 MolecularWeight: 418.96014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=CC(=O)NCC(C2=CC=CO2)N3CCCCC3)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)/C=C/C(=O)NCC(C2=CC=CO2)N3CCCCC3)Cl

InChI

InChI=1S/C22H31ClN4O2/c1-3-4-14-27-22(23)18(17(2)25-27)10-11-21(28)24-16-19(20-9-8-15-29-20)26-12-6-5-7-13-26/h8-11,15,19H,3-7,12-14,16H2,1-2H3,(H,24,28)/b11-10+