3-propyl-5-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-3H-furan-2-one

Systemtic Name: 3-propyl-5-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-3H-furan-2-one Openeye Name: 3-propyl-5-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-3H-furan-2-one CAS Name: 3-propyl-5-[(1H-1,2,4-triazol-5-ylthio)methyl]-3H-furan-2-one IUPAC Name: 3-propyl-5-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-3H-furan-2-one Traditional Name: 3-propyl-5-[(1H-1,2,4-triazol-5-ylthio)methyl]-3H-furan-2-one Formula: C10H13N3O2S MolecularWeight: 239.29412

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C=C(OC1=O)CSC2=NC=NN2

Isomeric SMILES

CCCC1C=C(OC1=O)CSC2=NC=NN2

InChI

InChI=1S/C10H13N3O2S/c1-2-3-7-4-8(15-9(7)14)5-16-10-11-6-12-13-10/h4,6-7H,2-3,5H2,1H3,(H,11,12,13)