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

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)pyrazole-4-carboxamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(6-mesyl-1,3-benzothiazol-2-yl)pyrazole-4-carboxamide Formula: C19H16N4O3S2 MolecularWeight: 412.48534

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CN(N=C3)CC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CN(N=C3)CC4=CC=CC=C4

InChI

InChI=1S/C19H16N4O3S2/c1-28(25,26)15-7-8-16-17(9-15)27-19(21-16)22-18(24)14-10-20-23(12-14)11-13-5-3-2-4-6-13/h2-10,12H,11H2,1H3,(H,21,22,24)