5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-methylsulfonylphenyl)-1H-pyrazole-4-carboxamide

Systemtic Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-methylsulfonylphenyl)-1H-pyrazole-4-carboxamide Openeye Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-methylsulfonylphenyl)-1H-pyrazole-4-carboxamide CAS Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-methylsulfonylphenyl)-1H-pyrazole-4-carboxamide IUPAC Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-methylsulfonylphenyl)-1H-pyrazole-4-carboxamide Traditional Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-mesylphenyl)-1H-pyrazole-4-carboxamide Formula: C19H17N3O5S MolecularWeight: 399.42038

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)C2=C(NN=C2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)C2=C(NN=C2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C19H17N3O5S/c1-28(24,25)14-4-2-3-13(10-14)21-19(23)15-11-20-22-18(15)12-5-6-16-17(9-12)27-8-7-26-16/h2-6,9-11H,7-8H2,1H3,(H,20,22)(H,21,23)