4-[1-[(4-chlorophenyl)methyl]-4,5-dimethyl-imidazol-2-yl]sulfanylbutanenitrile

Systemtic Name: 4-[1-[(4-chlorophenyl)methyl]-4,5-dimethyl-imidazol-2-yl]sulfanylbutanenitrile Openeye Name: 4-[1-[(4-chlorophenyl)methyl]-4,5-dimethyl-imidazol-2-yl]sulfanylbutanenitrile CAS Name: 4-[[1-[(4-chlorophenyl)methyl]-4,5-dimethyl-2-imidazolyl]thio]butanenitrile IUPAC Name: 4-[1-[(4-chlorophenyl)methyl]-4,5-dimethylimidazol-2-yl]sulfanylbutanenitrile Traditional Name: 4-[[1-(4-chlorobenzyl)-4,5-dimethyl-imidazol-2-yl]thio]butyronitrile Formula: C16H18ClN3S MolecularWeight: 319.85222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCCCC#N)CC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1=C(N(C(=N1)SCCCC#N)CC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C16H18ClN3S/c1-12-13(2)20(11-14-5-7-15(17)8-6-14)16(19-12)21-10-4-3-9-18/h5-8H,3-4,10-11H2,1-2H3