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

Systemtic Name: cyclopentyl 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoate Openeye Name: cyclopentyl 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetate CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]acetic acid cyclopentyl ester IUPAC Name: cyclopentyl 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]acetate Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]acetic acid cyclopentyl ester Formula: C9H14N4O2S MolecularWeight: 242.29806

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC(=O)CSC2=NNC(=N2)N

Isomeric SMILES

C1CCC(C1)OC(=O)CSC2=NNC(=N2)N

InChI

InChI=1S/C9H14N4O2S/c10-8-11-9(13-12-8)16-5-7(14)15-6-3-1-2-4-6/h6H,1-5H2,(H3,10,11,12,13)