2-(2-hydroxyethylsulfanyl)-6-methyl-quinoline-3-carbaldehyde

Systemtic Name: 2-(2-hydroxyethylsulfanyl)-6-methyl-quinoline-3-carbaldehyde Openeye Name: 2-(2-hydroxyethylsulfanyl)-6-methyl-quinoline-3-carbaldehyde CAS Name: 2-(2-hydroxyethylthio)-6-methyl-3-quinolinecarboxaldehyde IUPAC Name: 2-(2-hydroxyethylsulfanyl)-6-methylquinoline-3-carbaldehyde Traditional Name: 2-(2-hydroxyethylthio)-6-methyl-quinoline-3-carbaldehyde Formula: C13H13NO2S MolecularWeight: 247.31282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(N=C2C=C1)SCCO)C=O

Isomeric SMILES

CC1=CC2=CC(=C(N=C2C=C1)SCCO)C=O

InChI

InChI=1S/C13H13NO2S/c1-9-2-3-12-10(6-9)7-11(8-16)13(14-12)17-5-4-15/h2-3,6-8,15H,4-5H2,1H3