4-bromanyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-methyl-pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-methyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[4-(2,5-dimethoxyphenyl)thiazol-2-yl]-1-methyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-[4-(2,5-dimethoxyphenyl)-2-thiazolyl]-1-methyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-methylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-[4-(2,5-dimethoxyphenyl)thiazol-2-yl]-1-methyl-pyrazole-3-carboxamide Formula: C16H15BrN4O3S MolecularWeight: 423.2843

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NC2=NC(=CS2)C3=C(C=CC(=C3)OC)OC)Br

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NC2=NC(=CS2)C3=C(C=CC(=C3)OC)OC)Br

InChI

InChI=1S/C16H15BrN4O3S/c1-21-7-11(17)14(20-21)15(22)19-16-18-12(8-25-16)10-6-9(23-2)4-5-13(10)24-3/h4-8H,1-3H3,(H,18,19,22)