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

Systemtic Name: 2-[[5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1,2-dihydro-1,2,4-triazol-3-yl]sulfanyl]quinoline-3-carbaldehyde Openeye Name: 2-[[5-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-dihydro-1,2,4-triazol-3-yl]sulfanyl]quinoline-3-carbaldehyde CAS Name: 2-[[5-(4-oxo-1-cyclohexa-2,5-dienylidene)-1,2-dihydro-1,2,4-triazol-3-yl]thio]-3-quinolinecarboxaldehyde IUPAC Name: 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]quinoline-3-carbaldehyde Formula: C18H12N4O2S MolecularWeight: 348.37848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=N2)SC3=NC(=C4C=CC(=O)C=C4)NN3)C=O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)SC3=NC(=C4C=CC(=O)C=C4)NN3)C=O

InChI

InChI=1S/C18H12N4O2S/c23-10-13-9-12-3-1-2-4-15(12)19-17(13)25-18-20-16(21-22-18)11-5-7-14(24)8-6-11/h1-10,21H,(H,20,22)