3-[[5-[(2-chloranylphenoxy)methyl]-4-cyclopropyl-1,2,4-triazol-3-yl]sulfanyl]propanenitrile

Systemtic Name: 3-[[5-[(2-chloranylphenoxy)methyl]-4-cyclopropyl-1,2,4-triazol-3-yl]sulfanyl]propanenitrile Openeye Name: 3-[[5-[(2-chlorophenoxy)methyl]-4-cyclopropyl-1,2,4-triazol-3-yl]sulfanyl]propanenitrile CAS Name: 3-[[5-[(2-chlorophenoxy)methyl]-4-cyclopropyl-1,2,4-triazol-3-yl]thio]propanenitrile IUPAC Name: 3-[[5-[(2-chlorophenoxy)methyl]-4-cyclopropyl-1,2,4-triazol-3-yl]sulfanyl]propanenitrile Traditional Name: 3-[[5-[(2-chlorophenoxy)methyl]-4-cyclopropyl-1,2,4-triazol-3-yl]thio]propionitrile Formula: C15H15ClN4OS MolecularWeight: 334.8238

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCCC#N)COC3=CC=CC=C3Cl

Isomeric SMILES

C1CC1N2C(=NN=C2SCCC#N)COC3=CC=CC=C3Cl

InChI

InChI=1S/C15H15ClN4OS/c16-12-4-1-2-5-13(12)21-10-14-18-19-15(22-9-3-8-17)20(14)11-6-7-11/h1-2,4-5,11H,3,6-7,9-10H2