3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide

Systemtic Name: 3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: 3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide CAS Name: 3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-phenyl-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: 3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-phenylthieno[2,3-c]pyrazole-5-carboxamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide Formula: C21H16N4O3S3 MolecularWeight: 468.57174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C)C5=CC=CC=C5

InChI

InChI=1S/C21H16N4O3S3/c1-12-15-11-18(29-20(15)25(24-12)13-6-4-3-5-7-13)19(26)23-21-22-16-9-8-14(31(2,27)28)10-17(16)30-21/h3-11H,1-2H3,(H,22,23,26)