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

Systemtic Name: butyl 2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoate Openeye Name: butyl 2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]acetic acid butyl ester IUPAC Name: butyl 2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetate Traditional Name: 2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]acetic acid butyl ester Formula: C12H15N3O2S2 MolecularWeight: 297.3964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=NNC(=N1)C2=CC=CS2

Isomeric SMILES

CCCCOC(=O)CSC1=NNC(=N1)C2=CC=CS2

InChI

InChI=1S/C12H15N3O2S2/c1-2-3-6-17-10(16)8-19-12-13-11(14-15-12)9-5-4-7-18-9/h4-5,7H,2-3,6,8H2,1H3,(H,13,14,15)