[2-[4-(2-hydroxyethyloxy)-2-pyrimidin-2-yl-pyrimidin-5-yl]oxyphenyl] carbamate; 5-methylpyridine-2-sulfonic acid

Systemtic Name: [2-[4-(2-hydroxyethyloxy)-2-pyrimidin-2-yl-pyrimidin-5-yl]oxyphenyl] carbamate; 5-methylpyridine-2-sulfonic acid Openeye Name: [2-[4-(2-hydroxyethoxy)-2-pyrimidin-2-yl-pyrimidin-5-yl]oxyphenyl] carbamate; 5-methylpyridine-2-sulfonic acid CAS Name: carbamic acid [2-[[4-(2-hydroxyethoxy)-2-(2-pyrimidinyl)-5-pyrimidinyl]oxy]phenyl] ester; 5-methyl-2-pyridinesulfonic acid IUPAC Name: [2-[4-(2-hydroxyethoxy)-2-pyrimidin-2-ylpyrimidin-5-yl]oxyphenyl] carbamate; 5-methylpyridine-2-sulfonic acid Traditional Name: carbamic acid [2-[4-(2-hydroxyethoxy)-2-(2-pyrimidyl)pyrimidin-5-yl]oxyphenyl] ester; 5-methylpyridine-2-sulfonic acid Formula: C23H22N6O8S MolecularWeight: 542.52118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)S(=O)(=O)O.C1=CC=C(C(=C1)OC2=CN=C(N=C2OCCO)C3=NC=CC=N3)OC(=O)N

Isomeric SMILES

CC1=CN=C(C=C1)S(=O)(=O)O.C1=CC=C(C(=C1)OC2=CN=C(N=C2OCCO)C3=NC=CC=N3)OC(=O)N

InChI

InChI=1S/C17H15N5O5.C6H7NO3S/c18-17(24)27-12-5-2-1-4-11(12)26-13-10-21-15(14-19-6-3-7-20-14)22-16(13)25-9-8-23;1-5-2-3-6(7-4-5)11(8,9)10/h1-7,10,23H,8-9H2,(H2,18,24);2-4H,1H3,(H,8,9,10)