4-methoxy-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-phenyl-pyrazole-3-carboxamide

Systemtic Name: 4-methoxy-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-phenyl-pyrazole-3-carboxamide Openeye Name: 4-methoxy-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-phenyl-pyrazole-3-carboxamide CAS Name: 4-methoxy-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-phenyl-3-pyrazolecarboxamide IUPAC Name: 4-methoxy-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-phenylpyrazole-3-carboxamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-4-methoxy-1-phenyl-pyrazole-3-carboxamide Formula: C19H16N4O4S2 MolecularWeight: 428.48474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)C4=CC=CC=C4

Isomeric SMILES

COC1=CN(N=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C19H16N4O4S2/c1-27-15-11-23(12-6-4-3-5-7-12)22-17(15)18(24)21-19-20-14-9-8-13(29(2,25)26)10-16(14)28-19/h3-11H,1-2H3,(H,20,21,24)