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4-[3-[4-(2-methylimidazol-1-yl)phenyl]sulfanylphenyl]oxane-4-carbaldehyde

4-[3-[4-(2-methylimidazol-1-yl)phenyl]sulfanylphenyl]oxane-4-carbaldehyde

Systemtic Name:4-[3-[4-(2-methylimidazol-1-yl)phenyl]sulfanylphenyl]oxane-4-carbaldehyde
Openeye Name:4-[3-[4-(2-methylimidazol-1-yl)phenyl]sulfanylphenyl]tetrahydropyran-4-carbaldehyde
CAS Name:4-[3-[[4-(2-methyl-1-imidazolyl)phenyl]thio]phenyl]-4-oxanecarboxaldehyde
IUPAC Name:4-[3-[4-(2-methylimidazol-1-yl)phenyl]sulfanylphenyl]oxane-4-carbaldehyde
Traditional Name:4-[3-[[4-(2-methylimidazol-1-yl)phenyl]thio]phenyl]tetrahydropyran-4-carbaldehyde
Formula: C22H22N2O2S
MolecularWeight: 378.48728
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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=CC=C(C=C2)SC3=CC=CC(=C3)C4(CCOCC4)C=O


Isomeric SMILES

CC1=NC=CN1C2=CC=C(C=C2)SC3=CC=CC(=C3)C4(CCOCC4)C=O


InChI

InChI=1S/C22H22N2O2S/c1-17-23-11-12-24(17)19-5-7-20(8-6-19)27-21-4-2-3-18(15-21)22(16-25)9-13-26-14-10-22/h2-8,11-12,15-16H,9-10,13-14H2,1H3


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