1-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-phenyl-pyrazole-4-sulfonamide

Systemtic Name: 1-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-phenyl-pyrazole-4-sulfonamide Openeye Name: 1-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-phenyl-pyrazole-4-sulfonamide CAS Name: 1-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-phenyl-4-pyrazolesulfonamide IUPAC Name: 1-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-phenylpyrazole-4-sulfonamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-1-methyl-3-phenyl-pyrazole-4-sulfonamide Formula: C18H16N4O4S3 MolecularWeight: 448.53904

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=CC=C2)S(=O)(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=CC=C2)S(=O)(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C18H16N4O4S3/c1-22-11-16(17(20-22)12-6-4-3-5-7-12)29(25,26)21-18-19-14-9-8-13(28(2,23)24)10-15(14)27-18/h3-11H,1-2H3,(H,19,21)