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

Systemtic Name: ethyl 2-[[4-propan-2-yl-5-(5-propan-2-ylthiophen-3-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[4-isopropyl-5-(5-isopropyl-3-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-propan-2-yl-5-(5-propan-2-yl-3-thiophenyl)-1,2,4-triazol-3-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4-propan-2-yl-5-(5-propan-2-ylthiophen-3-yl)-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-isopropyl-5-(5-isopropyl-3-thienyl)-1,2,4-triazol-3-yl]thio]acetic acid ethyl ester Formula: C16H23N3O2S2 MolecularWeight: 353.50272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O2S2/c1-6-21-14(20)9-23-16-18-17-15(19(16)11(4)5)12-7-13(10(2)3)22-8-12/h7-8,10-11H,6,9H2,1-5H3