2-[(4-chlorophenyl)sulfanylmethyl]-1-[3-(2,6-dimethylphenoxy)propyl]benzimidazole

Systemtic Name: 2-[(4-chlorophenyl)sulfanylmethyl]-1-[3-(2,6-dimethylphenoxy)propyl]benzimidazole Openeye Name: 2-[(4-chlorophenyl)sulfanylmethyl]-1-[3-(2,6-dimethylphenoxy)propyl]benzimidazole CAS Name: 2-[[(4-chlorophenyl)thio]methyl]-1-[3-(2,6-dimethylphenoxy)propyl]benzimidazole IUPAC Name: 2-[(4-chlorophenyl)sulfanylmethyl]-1-[3-(2,6-dimethylphenoxy)propyl]benzimidazole Traditional Name: 2-[[(4-chlorophenyl)thio]methyl]-1-[3-(2,6-dimethylphenoxy)propyl]benzimidazole Formula: C25H25ClN2OS MolecularWeight: 436.9968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCCN2C3=CC=CC=C3N=C2CSC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCCN2C3=CC=CC=C3N=C2CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H25ClN2OS/c1-18-7-5-8-19(2)25(18)29-16-6-15-28-23-10-4-3-9-22(23)27-24(28)17-30-21-13-11-20(26)12-14-21/h3-5,7-14H,6,15-17H2,1-2H3