2-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(6-ethyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(6-ethyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[3-(4-ethoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-(6-ethyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(6-ethyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(6-ethyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-2-(3-p-phenetyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide Formula: C21H21N5O2S2 MolecularWeight: 439.55374

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3C(=NNC3=S)C4=CC=C(C=C4)OCC

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3C(=NNC3=S)C4=CC=C(C=C4)OCC

InChI

InChI=1S/C21H21N5O2S2/c1-3-13-5-10-16-17(11-13)30-20(22-16)23-18(27)12-26-19(24-25-21(26)29)14-6-8-15(9-7-14)28-4-2/h5-11H,3-4,12H2,1-2H3,(H,25,29)(H,22,23,27)