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

Systemtic Name: (E)-3-(2-chlorophenyl)-N-[2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]prop-2-enamide Openeye Name: (E)-3-(2-chlorophenyl)-N-[2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]prop-2-enamide CAS Name: (E)-3-(2-chlorophenyl)-N-[2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-thiophen-2-yl-3-pyrazolyl]-2-propenamide IUPAC Name: (E)-3-(2-chlorophenyl)-N-[2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]prop-2-enamide Traditional Name: (E)-3-(2-chlorophenyl)-N-[2-(4-keto-6-methyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]acrylamide Formula: C21H16ClN5O2S MolecularWeight: 437.90204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CS3)NC(=O)C=CC4=CC=CC=C4Cl

Isomeric SMILES

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CS3)NC(=O)/C=C/C4=CC=CC=C4Cl

InChI

InChI=1S/C21H16ClN5O2S/c1-13-11-20(29)25-21(23-13)27-18(12-16(26-27)17-7-4-10-30-17)24-19(28)9-8-14-5-2-3-6-15(14)22/h2-12H,1H3,(H,24,28)(H,23,25,29)/b9-8+