2-[[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-6-methoxy-quinoline-3-carbaldehyde

Systemtic Name: 2-[[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-6-methoxy-quinoline-3-carbaldehyde Openeye Name: 2-[[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-6-methoxy-quinoline-3-carbaldehyde CAS Name: 2-[[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]thio]-6-methoxy-3-quinolinecarboxaldehyde IUPAC Name: 2-[[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-6-methoxyquinoline-3-carbaldehyde Traditional Name: 2-[[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]thio]-6-methoxy-quinoline-3-carbaldehyde Formula: C19H13ClN4O2S MolecularWeight: 396.85012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC(=C(N=C2C=C1)SC3=NNC(=N3)C4=CC=C(C=C4)Cl)C=O

Isomeric SMILES

COC1=CC2=CC(=C(N=C2C=C1)SC3=NNC(=N3)C4=CC=C(C=C4)Cl)C=O

InChI

InChI=1S/C19H13ClN4O2S/c1-26-15-6-7-16-12(9-15)8-13(10-25)18(21-16)27-19-22-17(23-24-19)11-2-4-14(20)5-3-11/h2-10H,1H3,(H,22,23,24)