5-(naphthalen-2-ylcarbonylcarbamothioylamino)-1-(4-sulfamoylphenyl)pyrazole-4-carboxamide

Systemtic Name: 5-(naphthalen-2-ylcarbonylcarbamothioylamino)-1-(4-sulfamoylphenyl)pyrazole-4-carboxamide Openeye Name: 5-(naphthalene-2-carbonylcarbamothioylamino)-1-(4-sulfamoylphenyl)pyrazole-4-carboxamide CAS Name: 5-[[[[2-naphthalenyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]-1-(4-sulfamoylphenyl)-4-pyrazolecarboxamide IUPAC Name: 5-(naphthalene-2-carbonylcarbamothioylamino)-1-(4-sulfamoylphenyl)pyrazole-4-carboxamide Traditional Name: 5-(2-naphthoylthiocarbamoylamino)-1-(4-sulfamoylphenyl)pyrazole-4-carboxamide Formula: C22H18N6O4S2 MolecularWeight: 494.54612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(=O)NC(=S)NC3=C(C=NN3C4=CC=C(C=C4)S(=O)(=O)N)C(=O)N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(=O)NC(=S)NC3=C(C=NN3C4=CC=C(C=C4)S(=O)(=O)N)C(=O)N

InChI

InChI=1S/C22H18N6O4S2/c23-19(29)18-12-25-28(16-7-9-17(10-8-16)34(24,31)32)20(18)26-22(33)27-21(30)15-6-5-13-3-1-2-4-14(13)11-15/h1-12H,(H2,23,29)(H2,24,31,32)(H2,26,27,30,33)