2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]-1-phenethyl-benzimidazole

Systemtic Name: 2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]-1-phenethyl-benzimidazole Openeye Name: 2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]-1-phenethyl-benzimidazole CAS Name: 2-[2-(3,4-dimethylphenoxy)ethylthio]-1-phenethylbenzimidazole IUPAC Name: 2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]-1-phenethylbenzimidazole Traditional Name: 2-[2-(3,4-dimethylphenoxy)ethylthio]-1-phenethyl-benzimidazole Formula: C25H26N2OS MolecularWeight: 402.55174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCCSC2=NC3=CC=CC=C3N2CCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCCSC2=NC3=CC=CC=C3N2CCC4=CC=CC=C4)C

InChI

InChI=1S/C25H26N2OS/c1-19-12-13-22(18-20(19)2)28-16-17-29-25-26-23-10-6-7-11-24(23)27(25)15-14-21-8-4-3-5-9-21/h3-13,18H,14-17H2,1-2H3