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

Systemtic Name: methyl 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]furan-3-carboxylate Openeye Name: methyl 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanylmethyl]furan-3-carboxylate CAS Name: 2-[[(5-amino-1H-1,2,4-triazol-3-yl)thio]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanylmethyl]furan-3-carboxylate Traditional Name: 2-[[(5-amino-1H-1,2,4-triazol-3-yl)thio]methyl]furan-3-carboxylic acid methyl ester Formula: C9H10N4O3S MolecularWeight: 254.2657

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10N4O3S/c1-15-7(14)5-2-3-16-6(5)4-17-9-11-8(10)12-13-9/h2-3H,4H2,1H3,(H3,10,11,12,13)