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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-bromanyl-1-ethyl-pyrazole-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-bromo-1-ethyl-pyrazole-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-bromo-1-ethyl-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-bromo-1-ethylpyrazole-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-bromo-1-ethyl-pyrazole-3-carboxamide Formula: C13H11BrN4OS MolecularWeight: 351.22164

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=NC3=CC=CC=C3S2)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=NC3=CC=CC=C3S2)Br

InChI

InChI=1S/C13H11BrN4OS/c1-2-18-7-8(14)11(17-18)12(19)16-13-15-9-5-3-4-6-10(9)20-13/h3-7H,2H2,1H3,(H,15,16,19)