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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NN=C(N1C)C2=CSC(=C2)C

Isomeric SMILES

CCOC(=O)CSC1=NN=C(N1C)C2=CSC(=C2)C

InChI

InChI=1S/C12H15N3O2S2/c1-4-17-10(16)7-19-12-14-13-11(15(12)3)9-5-8(2)18-6-9/h5-6H,4,7H2,1-3H3