2-(3,4-dimethyl-5-pyrimidin-2-ylsulfonyl-phenyl)-5-oxidanyl-benzaldehyde

Systemtic Name: 2-(3,4-dimethyl-5-pyrimidin-2-ylsulfonyl-phenyl)-5-oxidanyl-benzaldehyde Openeye Name: 2-(3,4-dimethyl-5-pyrimidin-2-ylsulfonyl-phenyl)-5-hydroxy-benzaldehyde CAS Name: 2-[3,4-dimethyl-5-(2-pyrimidinylsulfonyl)phenyl]-5-hydroxybenzaldehyde IUPAC Name: 2-(3,4-dimethyl-5-pyrimidin-2-ylsulfonylphenyl)-5-hydroxybenzaldehyde Traditional Name: 2-[3,4-dimethyl-5-(2-pyrimidylsulfonyl)phenyl]-5-hydroxy-benzaldehyde Formula: C19H16N2O4S MolecularWeight: 368.40634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C2=C(C=C(C=C2)O)C=O)S(=O)(=O)C3=NC=CC=N3)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C2=C(C=C(C=C2)O)C=O)S(=O)(=O)C3=NC=CC=N3)C

InChI

InChI=1S/C19H16N2O4S/c1-12-8-14(17-5-4-16(23)9-15(17)11-22)10-18(13(12)2)26(24,25)19-20-6-3-7-21-19/h3-11,23H,1-2H3