ethyl 4-aminocarbonyl-5-[2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)butanoylamino]-2-methyl-furan-3-carboxylate

Systemtic Name: ethyl 4-aminocarbonyl-5-[2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)butanoylamino]-2-methyl-furan-3-carboxylate Openeye Name: ethyl 5-[2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)butanoylamino]-4-carbamoyl-2-methyl-furan-3-carboxylate CAS Name: 5-[[2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-1-oxobutyl]amino]-4-carbamoyl-2-methyl-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)butanoylamino]-4-carbamoyl-2-methylfuran-3-carboxylate Traditional Name: 5-[2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]butanoylamino]-4-carbamoyl-2-methyl-furan-3-carboxylic acid ethyl ester Formula: C17H24N6O5S MolecularWeight: 424.47466

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=C(O1)C)C(=O)OCC)C(=O)N)N2C(=NN=C2SCC)N

Isomeric SMILES

CCC(C(=O)NC1=C(C(=C(O1)C)C(=O)OCC)C(=O)N)N2C(=NN=C2SCC)N

InChI

InChI=1S/C17H24N6O5S/c1-5-9(23-16(19)21-22-17(23)29-7-3)13(25)20-14-11(12(18)24)10(8(4)28-14)15(26)27-6-2/h9H,5-7H2,1-4H3,(H2,18,24)(H2,19,21)(H,20,25)