(E)-N-butyl-3-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-2-cyano-prop-2-enamide

Systemtic Name: (E)-N-butyl-3-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-2-cyano-prop-2-enamide Openeye Name: (E)-N-butyl-3-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-2-cyano-prop-2-enamide CAS Name: (E)-N-butyl-3-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-2-cyano-2-propenamide IUPAC Name: (E)-N-butyl-3-[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-2-cyanoprop-2-enamide Traditional Name: (E)-N-butyl-3-[1-(2-chlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]-2-cyano-acrylamide Formula: C20H23ClN4O MolecularWeight: 370.87582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(=CC1=C(N(N=C1C)CC2=CC=CC=C2Cl)C)C#N

Isomeric SMILES

CCCCNC(=O)/C(=C/C1=C(N(N=C1C)CC2=CC=CC=C2Cl)C)/C#N

InChI

InChI=1S/C20H23ClN4O/c1-4-5-10-23-20(26)17(12-22)11-18-14(2)24-25(15(18)3)13-16-8-6-7-9-19(16)21/h6-9,11H,4-5,10,13H2,1-3H3,(H,23,26)/b17-11+