O-[6-[(4-methylphenyl)sulfonylcarbamoylamino]-2-sulfanylidene-1H-pyrimidin-4-yl] 4-sulfamoylbenzenecarbothioate

Systemtic Name: O-[6-[(4-methylphenyl)sulfonylcarbamoylamino]-2-sulfanylidene-1H-pyrimidin-4-yl] 4-sulfamoylbenzenecarbothioate Openeye Name: O-[6-(p-tolylsulfonylcarbamoylamino)-2-thioxo-1H-pyrimidin-4-yl] 4-sulfamoylbenzenecarbothioate CAS Name: 4-sulfamoylbenzenecarbothioic acid O-[6-[[[(4-methylphenyl)sulfonylamino]-oxomethyl]amino]-2-sulfanylidene-1H-pyrimidin-4-yl] ester IUPAC Name: O-[6-[(4-methylphenyl)sulfonylcarbamoylamino]-2-sulfanylidene-1H-pyrimidin-4-yl] 4-sulfamoylbenzenecarbothioate Traditional Name: 4-sulfamoylthiobenzoic acid O-[2-thioxo-6-(tosylcarbamoylamino)-1H-pyrimidin-4-yl] ester Formula: C19H17N5O6S4 MolecularWeight: 539.62818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC(=NC(=S)N2)OC(=S)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC(=NC(=S)N2)OC(=S)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C19H17N5O6S4/c1-11-2-6-14(7-3-11)34(28,29)24-18(25)21-15-10-16(23-19(32)22-15)30-17(31)12-4-8-13(9-5-12)33(20,26)27/h2-10H,1H3,(H2,20,26,27)(H3,21,22,23,24,25,32)