6-methoxy-2-[[5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1,2-dihydro-1,2,4-triazol-3-yl]sulfanyl]quinoline-3-carbaldehyde

Systemtic Name: 6-methoxy-2-[[5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1,2-dihydro-1,2,4-triazol-3-yl]sulfanyl]quinoline-3-carbaldehyde Openeye Name: 6-methoxy-2-[[5-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-dihydro-1,2,4-triazol-3-yl]sulfanyl]quinoline-3-carbaldehyde CAS Name: 6-methoxy-2-[[5-(4-oxo-1-cyclohexa-2,5-dienylidene)-1,2-dihydro-1,2,4-triazol-3-yl]thio]-3-quinolinecarboxaldehyde IUPAC Name: 6-methoxy-2-[[5-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-dihydro-1,2,4-triazol-3-yl]sulfanyl]quinoline-3-carbaldehyde Traditional Name: 2-[[5-(4-ketocyclohexa-2,5-dien-1-ylidene)-1,2-dihydro-1,2,4-triazol-3-yl]thio]-6-methoxy-quinoline-3-carbaldehyde Formula: C19H14N4O3S MolecularWeight: 378.40446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC(=C(N=C2C=C1)SC3=NC(=C4C=CC(=O)C=C4)NN3)C=O

Isomeric SMILES

COC1=CC2=CC(=C(N=C2C=C1)SC3=NC(=C4C=CC(=O)C=C4)NN3)C=O

InChI

InChI=1S/C19H14N4O3S/c1-26-15-6-7-16-12(9-15)8-13(10-24)18(20-16)27-19-21-17(22-23-19)11-2-4-14(25)5-3-11/h2-10,22H,1H3,(H,21,23)