4-iodanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-1H-pyrazole-5-carboxamide

Systemtic Name: 4-iodanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-1H-pyrazole-5-carboxamide Openeye Name: 4-iodo-N-(6-methoxy-1,3-benzothiazol-2-yl)-1H-pyrazole-5-carboxamide CAS Name: 4-iodo-N-(6-methoxy-1,3-benzothiazol-2-yl)-1H-pyrazole-5-carboxamide IUPAC Name: 4-iodo-N-(6-methoxy-1,3-benzothiazol-2-yl)-1H-pyrazole-5-carboxamide Traditional Name: 4-iodo-N-(6-methoxy-1,3-benzothiazol-2-yl)-1H-pyrazole-5-carboxamide Formula: C12H9IN4O2S MolecularWeight: 400.19493

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C=NN3)I

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C=NN3)I

InChI

InChI=1S/C12H9IN4O2S/c1-19-6-2-3-8-9(4-6)20-12(15-8)16-11(18)10-7(13)5-14-17-10/h2-5H,1H3,(H,14,17)(H,15,16,18)