diethyl 2-[2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)ethanoylamino]-5-methyl-furan-3,4-dicarboxylate

Systemtic Name: diethyl 2-[2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)ethanoylamino]-5-methyl-furan-3,4-dicarboxylate Openeye Name: diethyl 2-[[2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)acetyl]amino]-5-methyl-furan-3,4-dicarboxylate CAS Name: 2-[[2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-1-oxoethyl]amino]-5-methylfuran-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-[[2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)acetyl]amino]-5-methylfuran-3,4-dicarboxylate Traditional Name: 2-[[2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]acetyl]amino]-5-methyl-furan-3,4-dicarboxylic acid diethyl ester Formula: C17H23N5O6S MolecularWeight: 425.45942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)OCC)NC(=O)CN2C(=NN=C2SCC)N)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)OCC)NC(=O)CN2C(=NN=C2SCC)N)C

InChI

InChI=1S/C17H23N5O6S/c1-5-26-14(24)11-9(4)28-13(12(11)15(25)27-6-2)19-10(23)8-22-16(18)20-21-17(22)29-7-3/h5-8H2,1-4H3,(H2,18,20)(H,19,23)