4-[2-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenecarbonitrile Openeye Name: 4-[2-[[4-methyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzonitrile CAS Name: 4-[2-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]ethoxy]benzonitrile IUPAC Name: 4-[2-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzonitrile Traditional Name: 4-[2-[[4-methyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]ethoxy]benzonitrile Formula: C17H16N4OS2 MolecularWeight: 356.46514

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCOC2=CC=C(C=C2)C#N)CC3=CC=CS3

Isomeric SMILES

CN1C(=NN=C1SCCOC2=CC=C(C=C2)C#N)CC3=CC=CS3

InChI

InChI=1S/C17H16N4OS2/c1-21-16(11-15-3-2-9-23-15)19-20-17(21)24-10-8-22-14-6-4-13(12-18)5-7-14/h2-7,9H,8,10-11H2,1H3