AC1M3LJH structure

AC1M3LJH

ethyl 4-(5-methylfuran-2-yl)-2-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]thiophene-3-carboxylate

Also Known As: J3.459.182B|VU0159146-4|F3394-1175|SR-01000281038-1|ethyl 4-(5-methylfuran-2-yl)-2-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]thiophene-3-carboxylate|4-(5-methyl-2-furanyl)-2-[[1-oxo-2-(1H-1,2,4-triazol-5-ylthio)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester|ethyl 4-(5-methyl-2-furyl)-2-{[(1H-1,2,4-triazol-3-ylthio)acetyl]amino}-3-thiophenecarboxylate|ethyl 4-(5-methylfuran-2-yl)-2-[2-(1H-1,2,4-triazol-3-ylsulfanyl)acetamido]thiophene-3-carboxylate|2-(1-Oxo-2-(2H-1,2,4-triazole-3-ylthio)ethylamino)-4-(5-methyl-2-furyl)thiophene-3-carboxylic acid ethyl ester|4-(5-methyl-2-furyl)-2-[[2-(1H-1,2,4-triazol-5-ylthio)acetyl]amino]thiophene-3-carboxylic acid ethyl ester|ethyl 2-(2-((1H-1,2,4-triazol-3-yl)thio)acetamido)-4-(5-methylfuran-2-yl)thiophene-3-carboxylate|ethyl 4-(5-methyl-2-furyl)-2-{[(1H-1,2,4-triazol-3-ylthio)methyl]carbonylamino}-3-thenoate|ethyl 4-(5-methylfuran-2-yl)-2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamido]thiophene-3-carboxylate|ethyl 4-(5-methylfuran-2-yl)-2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]thiophene-3-carboxylate

CAS: 690646-84-5
Molecular Formula C16H16N4O4S2
Molecular Weight 392.0613 g/mol
LogP 3.34212
Topological Polar Surface Area 110.11 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 8
Rotatable Bonds 7
Exact Mass 392.0613
Monoisotopic Mass 392.0613
Heavy Atoms 26
Complexity 901.39764

Chemical Identifiers

CAS Number 690646-84-5
SMILES CCOC(=O)C1=C(SC=C1C2=CC=C(O2)C)NC(=O)CSC3=NC=NN3

Product Overview

AC1M3LJH (CAS 690646-84-5), with molecular formula C16H16N4O4S2 and molecular weight 392.0613 g/mol. IUPAC: ethyl 4-(5-methylfuran-2-yl)-2-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]thiophene-3-carboxylate.

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