4-[5-(4-chlorophenyl)sulfanyl-1-methyl-imidazol-4-yl]benzenecarbonitrile

Systemtic Name: 4-[5-(4-chlorophenyl)sulfanyl-1-methyl-imidazol-4-yl]benzenecarbonitrile Openeye Name: 4-[5-(4-chlorophenyl)sulfanyl-1-methyl-imidazol-4-yl]benzonitrile CAS Name: 4-[5-[(4-chlorophenyl)thio]-1-methyl-4-imidazolyl]benzonitrile IUPAC Name: 4-[5-(4-chlorophenyl)sulfanyl-1-methylimidazol-4-yl]benzonitrile Traditional Name: 4-[5-[(4-chlorophenyl)thio]-1-methyl-imidazol-4-yl]benzonitrile Formula: C17H12ClN3S MolecularWeight: 325.81528

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1SC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)C#N

Isomeric SMILES

CN1C=NC(=C1SC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H12ClN3S/c1-21-11-20-16(13-4-2-12(10-19)3-5-13)17(21)22-15-8-6-14(18)7-9-15/h2-9,11H,1H3