3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-(2-ethylmorpholin-4-yl)propan-1-one

Systemtic Name: 3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-(2-ethylmorpholin-4-yl)propan-1-one Openeye Name: 3-[3-(4-ethoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-1-(2-ethylmorpholin-4-yl)propan-1-one CAS Name: 3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-(2-ethyl-4-morpholinyl)-1-propanone IUPAC Name: 3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-(2-ethylmorpholin-4-yl)propan-1-one Traditional Name: 1-(2-ethylmorpholino)-3-(3-p-phenetyl-5-thioxo-1H-1,2,4-triazol-4-yl)propan-1-one Formula: C19H26N4O3S MolecularWeight: 390.49974

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCO1)C(=O)CCN2C(=NNC2=S)C3=CC=C(C=C3)OCC

Isomeric SMILES

CCC1CN(CCO1)C(=O)CCN2C(=NNC2=S)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C19H26N4O3S/c1-3-15-13-22(11-12-26-15)17(24)9-10-23-18(20-21-19(23)27)14-5-7-16(8-6-14)25-4-2/h5-8,15H,3-4,9-13H2,1-2H3,(H,21,27)