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

Systemtic Name: methyl 3-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 3-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 3-methyl-5-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 3-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 3-methyl-5-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C11H13N3O3S MolecularWeight: 267.30422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)CSC2=NN=CN2C)C(=O)OC

Isomeric SMILES

CC1=C(OC(=C1)CSC2=NN=CN2C)C(=O)OC

InChI

InChI=1S/C11H13N3O3S/c1-7-4-8(17-9(7)10(15)16-3)5-18-11-13-12-6-14(11)2/h4,6H,5H2,1-3H3