(E)-N-[5-tert-butyl-2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]-3-(2-chlorophenyl)prop-2-enamide

Systemtic Name: (E)-N-[5-tert-butyl-2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]-3-(2-chlorophenyl)prop-2-enamide Openeye Name: (E)-N-[5-tert-butyl-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-3-(2-chlorophenyl)prop-2-enamide CAS Name: (E)-N-[5-tert-butyl-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)-3-pyrazolyl]-3-(2-chlorophenyl)-2-propenamide IUPAC Name: (E)-N-[5-tert-butyl-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-3-(2-chlorophenyl)prop-2-enamide Traditional Name: (E)-N-[5-tert-butyl-2-(4-keto-6-methyl-1H-pyrimidin-2-yl)pyrazol-3-yl]-3-(2-chlorophenyl)acrylamide Formula: C21H22ClN5O2 MolecularWeight: 411.88468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C(C)(C)C)NC(=O)C=CC3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C(C)(C)C)NC(=O)/C=C/C3=CC=CC=C3Cl

InChI

InChI=1S/C21H22ClN5O2/c1-13-11-19(29)25-20(23-13)27-17(12-16(26-27)21(2,3)4)24-18(28)10-9-14-7-5-6-8-15(14)22/h5-12H,1-4H3,(H,24,28)(H,23,25,29)/b10-9+