ethyl 2-[[5-(5-ethylthiophen-3-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[5-(5-ethylthiophen-3-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[4-allyl-5-(5-ethyl-3-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[5-(5-ethyl-3-thiophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-(5-ethylthiophen-3-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-allyl-5-(5-ethyl-3-thienyl)-1,2,4-triazol-3-yl]thio]acetic acid ethyl ester Formula: C15H19N3O2S2 MolecularWeight: 337.46026

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CS1)C2=NN=C(N2CC=C)SCC(=O)OCC

Isomeric SMILES

CCC1=CC(=CS1)C2=NN=C(N2CC=C)SCC(=O)OCC

InChI

InChI=1S/C15H19N3O2S2/c1-4-7-18-14(11-8-12(5-2)21-9-11)16-17-15(18)22-10-13(19)20-6-3/h4,8-9H,1,5-7,10H2,2-3H3