1-[(4-iodanyl-1-methyl-pyrazol-3-yl)carbonylamino]-3-(4-sulfamoylphenyl)thiourea

Systemtic Name: 1-[(4-iodanyl-1-methyl-pyrazol-3-yl)carbonylamino]-3-(4-sulfamoylphenyl)thiourea Openeye Name: 1-[(4-iodo-1-methyl-pyrazole-3-carbonyl)amino]-3-(4-sulfamoylphenyl)thiourea CAS Name: 1-[[(4-iodo-1-methyl-3-pyrazolyl)-oxomethyl]amino]-3-(4-sulfamoylphenyl)thiourea IUPAC Name: 1-[(4-iodo-1-methylpyrazole-3-carbonyl)amino]-3-(4-sulfamoylphenyl)thiourea Traditional Name: 1-[(4-iodo-1-methyl-pyrazole-3-carbonyl)amino]-3-(4-sulfamoylphenyl)thiourea Formula: C12H13IN6O3S2 MolecularWeight: 480.30449

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NNC(=S)NC2=CC=C(C=C2)S(=O)(=O)N)I

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NNC(=S)NC2=CC=C(C=C2)S(=O)(=O)N)I

InChI

InChI=1S/C12H13IN6O3S2/c1-19-6-9(13)10(18-19)11(20)16-17-12(23)15-7-2-4-8(5-3-7)24(14,21)22/h2-6H,1H3,(H,16,20)(H2,14,21,22)(H2,15,17,23)