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

Systemtic Name: (E)-3-(2-chlorophenyl)-N-[5-methyl-2-(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)pyrazol-3-yl]prop-2-enamide Openeye Name: (E)-3-(2-chlorophenyl)-N-[5-methyl-2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)pyrazol-3-yl]prop-2-enamide CAS Name: (E)-3-(2-chlorophenyl)-N-[5-methyl-2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)-3-pyrazolyl]-2-propenamide IUPAC Name: (E)-3-(2-chlorophenyl)-N-[5-methyl-2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)pyrazol-3-yl]prop-2-enamide Traditional Name: (E)-3-(2-chlorophenyl)-N-[2-(4-keto-6-propyl-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]acrylamide Formula: C20H20ClN5O2 MolecularWeight: 397.8581

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C)NC(=O)C=CC3=CC=CC=C3Cl

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C)NC(=O)/C=C/C3=CC=CC=C3Cl

InChI

InChI=1S/C20H20ClN5O2/c1-3-6-15-12-19(28)24-20(22-15)26-17(11-13(2)25-26)23-18(27)10-9-14-7-4-5-8-16(14)21/h4-5,7-12H,3,6H2,1-2H3,(H,23,27)(H,22,24,28)/b10-9+