4-[3,4-bis(oxidanyl)phenyl]-6-(2-hydroxyphenyl)-3,4-dihydro-1H-pyrimidine-2-thione

Systemtic Name: 4-[3,4-bis(oxidanyl)phenyl]-6-(2-hydroxyphenyl)-3,4-dihydro-1H-pyrimidine-2-thione Openeye Name: 4-(3,4-dihydroxyphenyl)-6-(2-hydroxyphenyl)-3,4-dihydro-1H-pyrimidine-2-thione CAS Name: 4-(3,4-dihydroxyphenyl)-6-(2-hydroxyphenyl)-3,4-dihydro-1H-pyrimidine-2-thione IUPAC Name: 4-(3,4-dihydroxyphenyl)-6-(2-hydroxyphenyl)-3,4-dihydro-1H-pyrimidine-2-thione Traditional Name: 4-(3,4-dihydroxyphenyl)-6-(2-hydroxyphenyl)-3,4-dihydro-1H-pyrimidine-2-thione Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC(NC(=S)N2)C3=CC(=C(C=C3)O)O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC(NC(=S)N2)C3=CC(=C(C=C3)O)O)O

InChI

InChI=1S/C16H14N2O3S/c19-13-4-2-1-3-10(13)12-8-11(17-16(22)18-12)9-5-6-14(20)15(21)7-9/h1-8,11,19-21H,(H2,17,18,22)