N-[4-[4-(2,4-dichlorophenyl)-1-imidazol-1-yl-butan-2-yl]sulfanylphenyl]methanamide

Systemtic Name: N-[4-[4-(2,4-dichlorophenyl)-1-imidazol-1-yl-butan-2-yl]sulfanylphenyl]methanamide Openeye Name: N-[4-[3-(2,4-dichlorophenyl)-1-(imidazol-1-ylmethyl)propyl]sulfanylphenyl]formamide CAS Name: N-[4-[[4-(2,4-dichlorophenyl)-1-(1-imidazolyl)butan-2-yl]thio]phenyl]formamide IUPAC Name: N-[4-[4-(2,4-dichlorophenyl)-1-imidazol-1-ylbutan-2-yl]sulfanylphenyl]formamide Traditional Name: N-[4-[[3-(2,4-dichlorophenyl)-1-(imidazol-1-ylmethyl)propyl]thio]phenyl]formamide Formula: C20H19Cl2N3OS MolecularWeight: 420.35536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC=O)SC(CCC2=C(C=C(C=C2)Cl)Cl)CN3C=CN=C3

Isomeric SMILES

C1=CC(=CC=C1NC=O)SC(CCC2=C(C=C(C=C2)Cl)Cl)CN3C=CN=C3

InChI

InChI=1S/C20H19Cl2N3OS/c21-16-3-1-15(20(22)11-16)2-6-19(12-25-10-9-23-13-25)27-18-7-4-17(5-8-18)24-14-26/h1,3-5,7-11,13-14,19H,2,6,12H2,(H,24,26)