ethyl 2-[4-(furan-2-ylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[4-(furan-2-ylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]ethanoate Openeye Name: ethyl 2-[4-(2-furylmethyl)-5-thioxo-1H-1,2,4-triazol-3-yl]acetate CAS Name: 2-[4-(2-furanylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(furan-2-ylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]acetate Traditional Name: 2-[4-(2-furfuryl)-5-thioxo-1H-1,2,4-triazol-3-yl]acetic acid ethyl ester Formula: C11H13N3O3S MolecularWeight: 267.30422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NNC(=S)N1CC2=CC=CO2

Isomeric SMILES

CCOC(=O)CC1=NNC(=S)N1CC2=CC=CO2

InChI

InChI=1S/C11H13N3O3S/c1-2-16-10(15)6-9-12-13-11(18)14(9)7-8-4-3-5-17-8/h3-5H,2,6-7H2,1H3,(H,13,18)