[2-(4-chloranyl-2-pyrimidin-2-yl-pyrimidin-5-yl)oxyphenyl] carbamate; 5-pentylthiophene-2-sulfonic acid

Systemtic Name: [2-(4-chloranyl-2-pyrimidin-2-yl-pyrimidin-5-yl)oxyphenyl] carbamate; 5-pentylthiophene-2-sulfonic acid Openeye Name: [2-(4-chloro-2-pyrimidin-2-yl-pyrimidin-5-yl)oxyphenyl] carbamate; 5-pentylthiophene-2-sulfonic acid CAS Name: carbamic acid [2-[[4-chloro-2-(2-pyrimidinyl)-5-pyrimidinyl]oxy]phenyl] ester; 5-pentyl-2-thiophenesulfonic acid IUPAC Name: [2-(4-chloro-2-pyrimidin-2-ylpyrimidin-5-yl)oxyphenyl] carbamate; 5-pentylthiophene-2-sulfonic acid Traditional Name: 5-amylthiophene-2-sulfonic acid; carbamic acid [2-[4-chloro-2-(2-pyrimidyl)pyrimidin-5-yl]oxyphenyl] ester Formula: C24H24ClN5O6S2 MolecularWeight: 578.06026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(S1)S(=O)(=O)O.C1=CC=C(C(=C1)OC2=CN=C(N=C2Cl)C3=NC=CC=N3)OC(=O)N

Isomeric SMILES

CCCCCC1=CC=C(S1)S(=O)(=O)O.C1=CC=C(C(=C1)OC2=CN=C(N=C2Cl)C3=NC=CC=N3)OC(=O)N

InChI

InChI=1S/C15H10ClN5O3.C9H14O3S2/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;1-2-3-4-5-8-6-7-9(13-8)14(10,11)12/h1-8H,(H2,17,22);6-7H,2-5H2,1H3,(H,10,11,12)