4-bromanyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-ethyl-pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-ethyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-ethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-ethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-ethylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-ethyl-pyrazole-3-carboxamide Formula: C15H15BrN4O2S MolecularWeight: 395.2742

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Br)C(=O)NC2=NC3=C(S2)C=C(C=C3)OCC

Isomeric SMILES

CCN1C(=C(C=N1)Br)C(=O)NC2=NC3=C(S2)C=C(C=C3)OCC

InChI

InChI=1S/C15H15BrN4O2S/c1-3-20-13(10(16)8-17-20)14(21)19-15-18-11-6-5-9(22-4-2)7-12(11)23-15/h5-8H,3-4H2,1-2H3,(H,18,19,21)