(2-oxidanylidene-1,2-diphenyl-ethyl) 2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoate

Systemtic Name: (2-oxidanylidene-1,2-diphenyl-ethyl) 2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoate Openeye Name: (2-oxo-1,2-diphenyl-ethyl) 2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]acetic acid (2-oxo-1,2-diphenylethyl) ester IUPAC Name: (2-oxo-1,2-diphenylethyl) 2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetate Traditional Name: 2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetic acid desyl ester Formula: C24H21N3O3S2 MolecularWeight: 463.57184

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C24H21N3O3S2/c1-2-27-23(19-14-9-15-31-19)25-26-24(27)32-16-20(28)30-22(18-12-7-4-8-13-18)21(29)17-10-5-3-6-11-17/h3-15,22H,2,16H2,1H3