ethyl 2-[2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)propanoylamino]-4-ethanoyl-5-methyl-furan-3-carboxylate

Systemtic Name: ethyl 2-[2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)propanoylamino]-4-ethanoyl-5-methyl-furan-3-carboxylate Openeye Name: ethyl 4-acetyl-2-[2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)propanoylamino]-5-methyl-furan-3-carboxylate CAS Name: 4-acetyl-2-[[2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-1-oxopropyl]amino]-5-methyl-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-2-[2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)propanoylamino]-5-methylfuran-3-carboxylate Traditional Name: 4-acetyl-2-[2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]propanoylamino]-5-methyl-furan-3-carboxylic acid ethyl ester Formula: C16H21N5O5S MolecularWeight: 395.43344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N5O5S/c1-6-25-14(24)11-10(8(3)22)9(4)26-13(11)18-12(23)7(2)21-15(17)19-20-16(21)27-5/h7H,6H2,1-5H3,(H2,17,19)(H,18,23)