8-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]quinoline-3-carbaldehyde

Systemtic Name: 8-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]quinoline-3-carbaldehyde Openeye Name: 8-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]quinoline-3-carbaldehyde CAS Name: 8-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]-3-quinolinecarboxaldehyde IUPAC Name: 8-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]quinoline-3-carbaldehyde Traditional Name: 8-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]quinoline-3-carbaldehyde Formula: C19H14N4OS MolecularWeight: 346.40566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=CC(=C(N=C12)SC3=NNC(=N3)C4=CC=CC=C4)C=O

Isomeric SMILES

CC1=CC=CC2=CC(=C(N=C12)SC3=NNC(=N3)C4=CC=CC=C4)C=O

InChI

InChI=1S/C19H14N4OS/c1-12-6-5-9-14-10-15(11-24)18(20-16(12)14)25-19-21-17(22-23-19)13-7-3-2-4-8-13/h2-11H,1H3,(H,21,22,23)