N-(3-chloranyl-4-cyano-phenyl)-2-[4,5-dimethyl-1-(2-methylpropyl)imidazol-2-yl]sulfanyl-propanamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-2-[4,5-dimethyl-1-(2-methylpropyl)imidazol-2-yl]sulfanyl-propanamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-2-(1-isobutyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-propanamide CAS Name: N-(3-chloro-4-cyanophenyl)-2-[[4,5-dimethyl-1-(2-methylpropyl)-2-imidazolyl]thio]propanamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-2-[4,5-dimethyl-1-(2-methylpropyl)imidazol-2-yl]sulfanylpropanamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-2-[(1-isobutyl-4,5-dimethyl-imidazol-2-yl)thio]propionamide Formula: C19H23ClN4OS MolecularWeight: 390.93012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SC(C)C(=O)NC2=CC(=C(C=C2)C#N)Cl)CC(C)C)C

Isomeric SMILES

CC1=C(N(C(=N1)SC(C)C(=O)NC2=CC(=C(C=C2)C#N)Cl)CC(C)C)C

InChI

InChI=1S/C19H23ClN4OS/c1-11(2)10-24-13(4)12(3)22-19(24)26-14(5)18(25)23-16-7-6-15(9-21)17(20)8-16/h6-8,11,14H,10H2,1-5H3,(H,23,25)