2,5-bis(chloranyl)thiophene-3-sulfonic acid; [2-(4-chloranyl-2-pyrimidin-2-yl-pyrimidin-5-yl)oxyphenyl] carbamate

Systemtic Name: 2,5-bis(chloranyl)thiophene-3-sulfonic acid; [2-(4-chloranyl-2-pyrimidin-2-yl-pyrimidin-5-yl)oxyphenyl] carbamate Openeye Name: [2-(4-chloro-2-pyrimidin-2-yl-pyrimidin-5-yl)oxyphenyl] carbamate; 2,5-dichlorothiophene-3-sulfonic acid CAS Name: carbamic acid [2-[[4-chloro-2-(2-pyrimidinyl)-5-pyrimidinyl]oxy]phenyl] ester; 2,5-dichloro-3-thiophenesulfonic acid IUPAC Name: [2-(4-chloro-2-pyrimidin-2-ylpyrimidin-5-yl)oxyphenyl] carbamate; 2,5-dichlorothiophene-3-sulfonic acid Traditional Name: carbamic acid [2-[4-chloro-2-(2-pyrimidyl)pyrimidin-5-yl]oxyphenyl] ester; 2,5-dichlorothiophene-3-sulfonic acid Formula: C19H12Cl3N5O6S2 MolecularWeight: 576.81748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OC2=CN=C(N=C2Cl)C3=NC=CC=N3)OC(=O)N.C1=C(SC(=C1S(=O)(=O)O)Cl)Cl

Isomeric SMILES

C1=CC=C(C(=C1)OC2=CN=C(N=C2Cl)C3=NC=CC=N3)OC(=O)N.C1=C(SC(=C1S(=O)(=O)O)Cl)Cl

InChI

InChI=1S/C15H10ClN5O3.C4H2Cl2O3S2/c16-12-11(8-20-14(21-12)13-18-6-3-7-19-13)23-9-4-1-2-5-10(9)24-15(17)22;5-3-1-2(4(6)10-3)11(7,8)9/h1-8H,(H2,17,22);1H,(H,7,8,9)