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

Systemtic Name: methyl 5-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C12H14N4O3S MolecularWeight: 294.32956

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CSC2=NN=C(N2N)C3CC3

Isomeric SMILES

COC(=O)C1=CC=C(O1)CSC2=NN=C(N2N)C3CC3

InChI

InChI=1S/C12H14N4O3S/c1-18-11(17)9-5-4-8(19-9)6-20-12-15-14-10(16(12)13)7-2-3-7/h4-5,7H,2-3,6,13H2,1H3