N-(1,3-benzothiazol-2-yl)-4-iodanyl-2-methyl-pyrazole-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-iodanyl-2-methyl-pyrazole-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-iodo-2-methyl-pyrazole-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-iodo-2-methyl-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-iodo-2-methylpyrazole-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-iodo-2-methyl-pyrazole-3-carboxamide Formula: C12H9IN4OS MolecularWeight: 384.19553

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)I)C(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CN1C(=C(C=N1)I)C(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C12H9IN4OS/c1-17-10(7(13)6-14-17)11(18)16-12-15-8-4-2-3-5-9(8)19-12/h2-6H,1H3,(H,15,16,18)