3-[[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]propanenitrile

Systemtic Name: 3-[[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]propanenitrile Openeye Name: 3-[[3-(4-ethoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]amino]propanenitrile CAS Name: 3-[[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]propanenitrile IUPAC Name: 3-[[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]propanenitrile Traditional Name: 3-[(3-p-phenetyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]propionitrile Formula: C13H15N5OS MolecularWeight: 289.3561

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NNC(=S)N2NCCC#N

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NNC(=S)N2NCCC#N

InChI

InChI=1S/C13H15N5OS/c1-2-19-11-6-4-10(5-7-11)12-16-17-13(20)18(12)15-9-3-8-14/h4-7,15H,2-3,9H2,1H3,(H,17,20)