N-[(1S)-1-(4-ethoxyphenyl)ethyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-[(1S)-1-(4-ethoxyphenyl)ethyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[(1S)-1-(4-ethoxyphenyl)ethyl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-[(1S)-1-(4-ethoxyphenyl)ethyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[(1S)-1-(4-ethoxyphenyl)ethyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-[(1S)-1-p-phenetylethyl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C18H20N4O2S2 MolecularWeight: 388.507

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C)NC(=O)CN2C(=NNC2=S)C3=CC=CS3

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@H](C)NC(=O)CN2C(=NNC2=S)C3=CC=CS3

InChI

InChI=1S/C18H20N4O2S2/c1-3-24-14-8-6-13(7-9-14)12(2)19-16(23)11-22-17(20-21-18(22)25)15-5-4-10-26-15/h4-10,12H,3,11H2,1-2H3,(H,19,23)(H,21,25)/t12-/m0/s1