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

Systemtic Name: diethyl 2-[2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)propanoylamino]-5-methyl-furan-3,4-dicarboxylate Openeye Name: diethyl 2-[2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)propanoylamino]-5-methyl-furan-3,4-dicarboxylate CAS Name: 2-[[2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-1-oxopropyl]amino]-5-methylfuran-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-[2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)propanoylamino]-5-methylfuran-3,4-dicarboxylate Traditional Name: 2-[2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]propanoylamino]-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)C(C)N2C(=NN=C2SC)N)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)OCC)NC(=O)C(C)N2C(=NN=C2SC)N)C

InChI

InChI=1S/C17H23N5O6S/c1-6-26-14(24)10-9(4)28-13(11(10)15(25)27-7-2)19-12(23)8(3)22-16(18)20-21-17(22)29-5/h8H,6-7H2,1-5H3,(H2,18,20)(H,19,23)