[6,7-dimethoxy-9-(4-methoxyphenyl)-3-methyl-2-phenylsulfanyl-benzo[f]benzimidazol-5-yl] ethanoate

Systemtic Name: [6,7-dimethoxy-9-(4-methoxyphenyl)-3-methyl-2-phenylsulfanyl-benzo[f]benzimidazol-5-yl] ethanoate Openeye Name: [6,7-dimethoxy-9-(4-methoxyphenyl)-3-methyl-2-phenylsulfanyl-benzo[f]benzimidazol-5-yl] acetate CAS Name: acetic acid [6,7-dimethoxy-9-(4-methoxyphenyl)-3-methyl-2-(phenylthio)-5-benzo[f]benzimidazolyl] ester IUPAC Name: [6,7-dimethoxy-9-(4-methoxyphenyl)-3-methyl-2-phenylsulfanylbenzo[f]benzimidazol-5-yl] acetate Traditional Name: acetic acid [6,7-dimethoxy-9-(4-methoxyphenyl)-3-methyl-2-(phenylthio)benzo[f]benzimidazol-5-yl] ester Formula: C29H26N2O5S MolecularWeight: 514.59214

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(=CC2=C(C3=C(C=C21)N(C(=N3)SC4=CC=CC=C4)C)C5=CC=C(C=C5)OC)OC)OC

Isomeric SMILES

CC(=O)OC1=C(C(=CC2=C(C3=C(C=C21)N(C(=N3)SC4=CC=CC=C4)C)C5=CC=C(C=C5)OC)OC)OC

InChI

InChI=1S/C29H26N2O5S/c1-17(32)36-27-22-15-23-26(30-29(31(23)2)37-20-9-7-6-8-10-20)25(18-11-13-19(33-3)14-12-18)21(22)16-24(34-4)28(27)35-5/h6-16H,1-5H3