2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-1-[1-(3-methoxypropyl)-2,5-dimethyl-pyrrol-3-yl]ethanone

Systemtic Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-1-[1-(3-methoxypropyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Openeye Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-1-[1-(3-methoxypropyl)-2,5-dimethyl-pyrrol-3-yl]ethanone CAS Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)thio]-1-[1-(3-methoxypropyl)-2,5-dimethyl-3-pyrrolyl]ethanone IUPAC Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-1-[1-(3-methoxypropyl)-2,5-dimethylpyrrol-3-yl]ethanone Traditional Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)thio]-1-[1-(3-methoxypropyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCCOC)C)C(=O)CSC2=NC3=C(N2)C=C(C=C3)OC

Isomeric SMILES

CC1=CC(=C(N1CCCOC)C)C(=O)CSC2=NC3=C(N2)C=C(C=C3)OC

InChI

InChI=1S/C20H25N3O3S/c1-13-10-16(14(2)23(13)8-5-9-25-3)19(24)12-27-20-21-17-7-6-15(26-4)11-18(17)22-20/h6-7,10-11H,5,8-9,12H2,1-4H3,(H,21,22)