1-butyl-5-(furan-2-ylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 1-butyl-5-(furan-2-ylmethylsulfanyl)-1,2,4-triazole Openeye Name: 1-butyl-5-(2-furylmethylsulfanyl)-1,2,4-triazole CAS Name: 1-butyl-5-(2-furanylmethylthio)-1,2,4-triazole IUPAC Name: 1-butyl-5-(furan-2-ylmethylsulfanyl)-1,2,4-triazole Traditional Name: 1-butyl-5-(2-furfurylthio)-1,2,4-triazole Formula: C11H15N3OS MolecularWeight: 237.3213

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC=N1)SCC2=CC=CO2

Isomeric SMILES

CCCCN1C(=NC=N1)SCC2=CC=CO2

InChI

InChI=1S/C11H15N3OS/c1-2-3-6-14-11(12-9-13-14)16-8-10-5-4-7-15-10/h4-5,7,9H,2-3,6,8H2,1H3