2-[2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]-1-morpholino-ethanone CAS Name: 2-[2-[2-(3,4-dimethylphenoxy)ethylthio]-1-benzimidazolyl]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]-1-morpholin-4-ylethanone Traditional Name: 2-[2-[2-(3,4-dimethylphenoxy)ethylthio]benzimidazol-1-yl]-1-morpholino-ethanone Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCCSC2=NC3=CC=CC=C3N2CC(=O)N4CCOCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCCSC2=NC3=CC=CC=C3N2CC(=O)N4CCOCC4)C

InChI

InChI=1S/C23H27N3O3S/c1-17-7-8-19(15-18(17)2)29-13-14-30-23-24-20-5-3-4-6-21(20)26(23)16-22(27)25-9-11-28-12-10-25/h3-8,15H,9-14,16H2,1-2H3