2-[[5-[(4-chloranyl-2-methyl-phenoxy)methyl]-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanyl]ethanenitrile

Systemtic Name: 2-[[5-[(4-chloranyl-2-methyl-phenoxy)methyl]-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanyl]ethanenitrile Openeye Name: 2-[[5-[(4-chloro-2-methyl-phenoxy)methyl]-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanyl]acetonitrile CAS Name: 2-[[5-[(4-chloro-2-methylphenoxy)methyl]-4-cyclohexyl-1,2,4-triazol-3-yl]thio]acetonitrile IUPAC Name: 2-[[5-[(4-chloro-2-methylphenoxy)methyl]-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanyl]acetonitrile Traditional Name: 2-[[5-[(4-chloro-2-methyl-phenoxy)methyl]-4-cyclohexyl-1,2,4-triazol-3-yl]thio]acetonitrile Formula: C18H21ClN4OS MolecularWeight: 376.90354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCC2=NN=C(N2C3CCCCC3)SCC#N

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCC2=NN=C(N2C3CCCCC3)SCC#N

InChI

InChI=1S/C18H21ClN4OS/c1-13-11-14(19)7-8-16(13)24-12-17-21-22-18(25-10-9-20)23(17)15-5-3-2-4-6-15/h7-8,11,15H,2-6,10,12H2,1H3