2-[[5-(5-chloranyl-2-methoxy-phenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 2-[[5-(5-chloranyl-2-methoxy-phenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[[5-(5-chloro-2-methoxy-phenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile CAS Name: 2-[[[5-(5-chloro-2-methoxyphenyl)-4-ethyl-1,2,4-triazol-3-yl]thio]methyl]benzonitrile IUPAC Name: 2-[[5-(5-chloro-2-methoxyphenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile Traditional Name: 2-[[[5-(5-chloro-2-methoxy-phenyl)-4-ethyl-1,2,4-triazol-3-yl]thio]methyl]benzonitrile Formula: C19H17ClN4OS MolecularWeight: 384.88248

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=CC=C2C#N)C3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=CC=C2C#N)C3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C19H17ClN4OS/c1-3-24-18(16-10-15(20)8-9-17(16)25-2)22-23-19(24)26-12-14-7-5-4-6-13(14)11-21/h4-10H,3,12H2,1-2H3