(E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-N-(4-pyrrolidin-1-ylcarbonylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-N-(4-pyrrolidin-1-ylcarbonylphenyl)prop-2-enamide Openeye Name: (E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-N-[4-(pyrrolidine-1-carbonyl)phenyl]prop-2-enamide CAS Name: (E)-3-(1-butyl-5-chloro-3-methyl-4-pyrazolyl)-N-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]-2-propenamide IUPAC Name: (E)-3-(1-butyl-5-chloro-3-methylpyrazol-4-yl)-N-[4-(pyrrolidine-1-carbonyl)phenyl]prop-2-enamide Traditional Name: (E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acrylamide Formula: C22H27ClN4O2 MolecularWeight: 414.92838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=CC(=O)NC2=CC=C(C=C2)C(=O)N3CCCC3)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)/C=C/C(=O)NC2=CC=C(C=C2)C(=O)N3CCCC3)Cl

InChI

InChI=1S/C22H27ClN4O2/c1-3-4-15-27-21(23)19(16(2)25-27)11-12-20(28)24-18-9-7-17(8-10-18)22(29)26-13-5-6-14-26/h7-12H,3-6,13-15H2,1-2H3,(H,24,28)/b12-11+