(4-butyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-(furan-3-yl)methanone

Systemtic Name: (4-butyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-(furan-3-yl)methanone Openeye Name: (4-butyl-5-thioxo-1H-1,2,4-triazol-3-yl)-(3-furyl)methanone CAS Name: (4-butyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-(3-furanyl)methanone IUPAC Name: (4-butyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-(furan-3-yl)methanone Traditional Name: (4-butyl-5-thioxo-1H-1,2,4-triazol-3-yl)-(3-furyl)methanone Formula: C11H13N3O2S MolecularWeight: 251.30482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NNC1=S)C(=O)C2=COC=C2

Isomeric SMILES

CCCCN1C(=NNC1=S)C(=O)C2=COC=C2

InChI

InChI=1S/C11H13N3O2S/c1-2-3-5-14-10(12-13-11(14)17)9(15)8-4-6-16-7-8/h4,6-7H,2-3,5H2,1H3,(H,13,17)