methyl 5-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-3-methyl-furan-2-carboxylate

Systemtic Name: methyl 5-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-3-methyl-furan-2-carboxylate Openeye Name: methyl 5-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-3-methyl-furan-2-carboxylate CAS Name: 5-[[(5-amino-1H-1,2,4-triazol-3-yl)thio]methyl]-3-methyl-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-3-methylfuran-2-carboxylate Traditional Name: 5-[[(5-amino-1H-1,2,4-triazol-3-yl)thio]methyl]-3-methyl-furan-2-carboxylic acid methyl ester Formula: C10H12N4O3S MolecularWeight: 268.29228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)CSC2=NNC(=N2)N)C(=O)OC

Isomeric SMILES

CC1=C(OC(=C1)CSC2=NNC(=N2)N)C(=O)OC

InChI

InChI=1S/C10H12N4O3S/c1-5-3-6(17-7(5)8(15)16-2)4-18-10-12-9(11)13-14-10/h3H,4H2,1-2H3,(H3,11,12,13,14)