4-[1-(4-chlorophenyl)-2-imidazol-1-yl-ethyl]sulfanylbenzenecarbonitrile

Systemtic Name: 4-[1-(4-chlorophenyl)-2-imidazol-1-yl-ethyl]sulfanylbenzenecarbonitrile Openeye Name: 4-[1-(4-chlorophenyl)-2-imidazol-1-yl-ethyl]sulfanylbenzonitrile CAS Name: 4-[[1-(4-chlorophenyl)-2-(1-imidazolyl)ethyl]thio]benzonitrile IUPAC Name: 4-[1-(4-chlorophenyl)-2-imidazol-1-ylethyl]sulfanylbenzonitrile Traditional Name: 4-[[1-(4-chlorophenyl)-2-imidazol-1-yl-ethyl]thio]benzonitrile Formula: C18H14ClN3S MolecularWeight: 339.84186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)SC(CN2C=CN=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC=C1C#N)SC(CN2C=CN=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H14ClN3S/c19-16-5-3-15(4-6-16)18(12-22-10-9-21-13-22)23-17-7-1-14(11-20)2-8-17/h1-10,13,18H,12H2