(E)-N-butyl-2-cyano-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enamide

Systemtic Name: (E)-N-butyl-2-cyano-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-3-(1-benzylpyrazol-4-yl)-N-butyl-2-cyano-prop-2-enamide CAS Name: (E)-N-butyl-2-cyano-3-[1-(phenylmethyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-3-(1-benzylpyrazol-4-yl)-N-butyl-2-cyanoprop-2-enamide Traditional Name: (E)-3-(1-benzylpyrazol-4-yl)-N-butyl-2-cyano-acrylamide Formula: C18H20N4O MolecularWeight: 308.3776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(=CC1=CN(N=C1)CC2=CC=CC=C2)C#N

Isomeric SMILES

CCCCNC(=O)/C(=C/C1=CN(N=C1)CC2=CC=CC=C2)/C#N

InChI

InChI=1S/C18H20N4O/c1-2-3-9-20-18(23)17(11-19)10-16-12-21-22(14-16)13-15-7-5-4-6-8-15/h4-8,10,12,14H,2-3,9,13H2,1H3,(H,20,23)/b17-10+