[2-[1-(4-chlorophenyl)sulfanyl-2-imidazol-1-yl-ethyl]phenyl] thiocyanate

Systemtic Name: [2-[1-(4-chlorophenyl)sulfanyl-2-imidazol-1-yl-ethyl]phenyl] thiocyanate Openeye Name: [2-[1-(4-chlorophenyl)sulfanyl-2-imidazol-1-yl-ethyl]phenyl] thiocyanate CAS Name: thiocyanic acid [2-[1-[(4-chlorophenyl)thio]-2-(1-imidazolyl)ethyl]phenyl] ester IUPAC Name: [2-[1-(4-chlorophenyl)sulfanyl-2-imidazol-1-ylethyl]phenyl] thiocyanate Traditional Name: thiocyanic acid [2-[1-[(4-chlorophenyl)thio]-2-imidazol-1-yl-ethyl]phenyl] ester Formula: C18H14ClN3S2 MolecularWeight: 371.90686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(CN2C=CN=C2)SC3=CC=C(C=C3)Cl)SC#N

Isomeric SMILES

C1=CC=C(C(=C1)C(CN2C=CN=C2)SC3=CC=C(C=C3)Cl)SC#N

InChI

InChI=1S/C18H14ClN3S2/c19-14-5-7-15(8-6-14)24-18(11-22-10-9-21-13-22)16-3-1-2-4-17(16)23-12-20/h1-10,13,18H,11H2