1-(7-ethyl-1H-indol-3-yl)-2-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]ethanone

Systemtic Name: 1-(7-ethyl-1H-indol-3-yl)-2-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]ethanone Openeye Name: 2-(2-benzylsulfanylbenzimidazol-1-yl)-1-(7-ethyl-1H-indol-3-yl)ethanone CAS Name: 1-(7-ethyl-1H-indol-3-yl)-2-[2-(phenylmethylthio)-1-benzimidazolyl]ethanone IUPAC Name: 2-(2-benzylsulfanylbenzimidazol-1-yl)-1-(7-ethyl-1H-indol-3-yl)ethanone Traditional Name: 2-[2-(benzylthio)benzimidazol-1-yl]-1-(7-ethyl-1H-indol-3-yl)ethanone Formula: C26H23N3OS MolecularWeight: 425.54532

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)CN3C4=CC=CC=C4N=C3SCC5=CC=CC=C5

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)CN3C4=CC=CC=C4N=C3SCC5=CC=CC=C5

InChI

InChI=1S/C26H23N3OS/c1-2-19-11-8-12-20-21(15-27-25(19)20)24(30)16-29-23-14-7-6-13-22(23)28-26(29)31-17-18-9-4-3-5-10-18/h3-15,27H,2,16-17H2,1H3