methyl 2-[2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]ethanoate Openeye Name: methyl 2-[[2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetate CAS Name: 2-[[2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetate Traditional Name: 2-[[2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]acetyl]amino]acetic acid methyl ester Formula: C12H18N4O3S MolecularWeight: 298.36132

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)CSC1=NNC(=N1)C2CCCC2

Isomeric SMILES

COC(=O)CNC(=O)CSC1=NNC(=N1)C2CCCC2

InChI

InChI=1S/C12H18N4O3S/c1-19-10(18)6-13-9(17)7-20-12-14-11(15-16-12)8-4-2-3-5-8/h8H,2-7H2,1H3,(H,13,17)(H,14,15,16)