N-[4-[[4-(2,4-dichlorophenyl)-1-imidazol-1-yl-butan-2-yl]sulfanylmethyl]phenyl]ethanamide

Systemtic Name: N-[4-[[4-(2,4-dichlorophenyl)-1-imidazol-1-yl-butan-2-yl]sulfanylmethyl]phenyl]ethanamide Openeye Name: N-[4-[[3-(2,4-dichlorophenyl)-1-(imidazol-1-ylmethyl)propyl]sulfanylmethyl]phenyl]acetamide CAS Name: N-[4-[[[4-(2,4-dichlorophenyl)-1-(1-imidazolyl)butan-2-yl]thio]methyl]phenyl]acetamide IUPAC Name: N-[4-[[4-(2,4-dichlorophenyl)-1-imidazol-1-ylbutan-2-yl]sulfanylmethyl]phenyl]acetamide Traditional Name: N-[4-[[[3-(2,4-dichlorophenyl)-1-(imidazol-1-ylmethyl)propyl]thio]methyl]phenyl]acetamide Formula: C22H23Cl2N3OS MolecularWeight: 448.40852

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CSC(CCC2=C(C=C(C=C2)Cl)Cl)CN3C=CN=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CSC(CCC2=C(C=C(C=C2)Cl)Cl)CN3C=CN=C3

InChI

InChI=1S/C22H23Cl2N3OS/c1-16(28)26-20-7-2-17(3-8-20)14-29-21(13-27-11-10-25-15-27)9-5-18-4-6-19(23)12-22(18)24/h2-4,6-8,10-12,15,21H,5,9,13-14H2,1H3,(H,26,28)