2-[(4-chlorophenyl)sulfanylmethyl]-1-[3-(5-methyl-2-propan-2-yl-phenoxy)propyl]benzimidazole

Systemtic Name: 2-[(4-chlorophenyl)sulfanylmethyl]-1-[3-(5-methyl-2-propan-2-yl-phenoxy)propyl]benzimidazole Openeye Name: 2-[(4-chlorophenyl)sulfanylmethyl]-1-[3-(2-isopropyl-5-methyl-phenoxy)propyl]benzimidazole CAS Name: 2-[[(4-chlorophenyl)thio]methyl]-1-[3-(5-methyl-2-propan-2-ylphenoxy)propyl]benzimidazole IUPAC Name: 2-[(4-chlorophenyl)sulfanylmethyl]-1-[3-(5-methyl-2-propan-2-ylphenoxy)propyl]benzimidazole Traditional Name: 2-[[(4-chlorophenyl)thio]methyl]-1-[3-(2-isopropyl-5-methyl-phenoxy)propyl]benzimidazole Formula: C27H29ClN2OS MolecularWeight: 465.04996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29ClN2OS/c1-19(2)23-14-9-20(3)17-26(23)31-16-6-15-30-25-8-5-4-7-24(25)29-27(30)18-32-22-12-10-21(28)11-13-22/h4-5,7-14,17,19H,6,15-16,18H2,1-3H3