4-[[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl]sulfanylmethyl]benzonitrile CAS Name: 4-[[[1-(2,4-dichlorophenyl)-2-(1-imidazolyl)ethyl]thio]methyl]benzonitrile IUPAC Name: 4-[[1-(2,4-dichlorophenyl)-2-imidazol-1-ylethyl]sulfanylmethyl]benzonitrile Traditional Name: 4-[[[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl]thio]methyl]benzonitrile Formula: C19H15Cl2N3S MolecularWeight: 388.3135

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)C#N

Isomeric SMILES

C1=CC(=CC=C1CSC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)C#N

InChI

InChI=1S/C19H15Cl2N3S/c20-16-5-6-17(18(21)9-16)19(11-24-8-7-23-13-24)25-12-15-3-1-14(10-22)2-4-15/h1-9,13,19H,11-12H2