4-[5-(4-chlorophenyl)sulfanyl-1-methyl-2-[1-(2-methyl-2-oxidanyl-propyl)pyrazol-3-yl]imidazol-4-yl]benzenecarbonitrile

Systemtic Name: 4-[5-(4-chlorophenyl)sulfanyl-1-methyl-2-[1-(2-methyl-2-oxidanyl-propyl)pyrazol-3-yl]imidazol-4-yl]benzenecarbonitrile Openeye Name: 4-[5-(4-chlorophenyl)sulfanyl-2-[1-(2-hydroxy-2-methyl-propyl)pyrazol-3-yl]-1-methyl-imidazol-4-yl]benzonitrile CAS Name: 4-[5-[(4-chlorophenyl)thio]-2-[1-(2-hydroxy-2-methylpropyl)-3-pyrazolyl]-1-methyl-4-imidazolyl]benzonitrile IUPAC Name: 4-[5-(4-chlorophenyl)sulfanyl-2-[1-(2-hydroxy-2-methylpropyl)pyrazol-3-yl]-1-methylimidazol-4-yl]benzonitrile Traditional Name: 4-[5-[(4-chlorophenyl)thio]-2-[1-(2-hydroxy-2-methyl-propyl)pyrazol-3-yl]-1-methyl-imidazol-4-yl]benzonitrile Formula: C24H22ClN5OS MolecularWeight: 463.98238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1C=CC(=N1)C2=NC(=C(N2C)SC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)C#N)O

Isomeric SMILES

CC(C)(CN1C=CC(=N1)C2=NC(=C(N2C)SC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)C#N)O

InChI

InChI=1S/C24H22ClN5OS/c1-24(2,31)15-30-13-12-20(28-30)22-27-21(17-6-4-16(14-26)5-7-17)23(29(22)3)32-19-10-8-18(25)9-11-19/h4-13,31H,15H2,1-3H3