(E)-3-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-N-(3-pyrazin-2-yloxyphenyl)prop-2-enamide

Systemtic Name: (E)-3-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-N-(3-pyrazin-2-yloxyphenyl)prop-2-enamide Openeye Name: (E)-3-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)-N-(3-pyrazin-2-yloxyphenyl)prop-2-enamide CAS Name: (E)-3-[5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]-N-[3-(2-pyrazinyloxy)phenyl]-2-propenamide IUPAC Name: (E)-3-[5-chloro-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-N-(3-pyrazin-2-yloxyphenyl)prop-2-enamide Traditional Name: (E)-3-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)-N-(3-pyrazin-2-yloxyphenyl)acrylamide Formula: C21H22ClN5O2 MolecularWeight: 411.88468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)NC2=CC(=CC=C2)OC3=NC=CN=C3)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)NC2=CC(=CC=C2)OC3=NC=CN=C3)Cl)CC(C)C

InChI

InChI=1S/C21H22ClN5O2/c1-14(2)13-27-21(22)18(15(3)26-27)7-8-19(28)25-16-5-4-6-17(11-16)29-20-12-23-9-10-24-20/h4-12,14H,13H2,1-3H3,(H,25,28)/b8-7+