ethyl 2-[[5-(butylcarbamoylamino)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[5-(butylcarbamoylamino)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[5-(butylcarbamoylamino)-1H-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[5-[[butylamino(oxo)methyl]amino]-1H-1,2,4-triazol-3-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-(butylcarbamoylamino)-1H-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[5-(butylcarbamoylamino)-1H-1,2,4-triazol-3-yl]thio]acetic acid ethyl ester Formula: C11H19N5O3S MolecularWeight: 301.36526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=NC(=NN1)SCC(=O)OCC

Isomeric SMILES

CCCCNC(=O)NC1=NC(=NN1)SCC(=O)OCC

InChI

InChI=1S/C11H19N5O3S/c1-3-5-6-12-10(18)13-9-14-11(16-15-9)20-7-8(17)19-4-2/h3-7H2,1-2H3,(H3,12,13,14,15,16,18)