2-[(4-azanyl-5-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-ethoxyphenyl)ethanone

Systemtic Name: 2-[(4-azanyl-5-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-ethoxyphenyl)ethanone Openeye Name: 2-[(4-amino-5-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-ethoxyphenyl)ethanone CAS Name: 2-[(4-amino-5-ethyl-1,2,4-triazol-3-yl)thio]-1-(4-ethoxyphenyl)ethanone IUPAC Name: 2-[(4-amino-5-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-ethoxyphenyl)ethanone Traditional Name: 2-[(4-amino-5-ethyl-1,2,4-triazol-3-yl)thio]-1-p-phenetyl-ethanone Formula: C14H18N4O2S MolecularWeight: 306.38332

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1N)SCC(=O)C2=CC=C(C=C2)OCC

Isomeric SMILES

CCC1=NN=C(N1N)SCC(=O)C2=CC=C(C=C2)OCC

InChI

InChI=1S/C14H18N4O2S/c1-3-13-16-17-14(18(13)15)21-9-12(19)10-5-7-11(8-6-10)20-4-2/h5-8H,3-4,9,15H2,1-2H3