4-[1-[(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]propylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[1-[(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]propylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[1-[(3-ethyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]propylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[1-[(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]propylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[1-[(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]propylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[1-[(3-ethyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]propylidene]cyclohexa-2,5-dien-1-one Formula: C13H16N4OS MolecularWeight: 276.35734

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=S)N1NC(=C2C=CC(=O)C=C2)CC

Isomeric SMILES

CCC1=NNC(=S)N1NC(=C2C=CC(=O)C=C2)CC

InChI

InChI=1S/C13H16N4OS/c1-3-11(9-5-7-10(18)8-6-9)16-17-12(4-2)14-15-13(17)19/h5-8,16H,3-4H2,1-2H3,(H,15,19)