2-bromanyl-4-(9-bromanyl-2,3-dimethyl-benzo[f][1]benzothiol-4-yl)-6-ethyl-phenol

Systemtic Name: 2-bromanyl-4-(9-bromanyl-2,3-dimethyl-benzo[f][1]benzothiol-4-yl)-6-ethyl-phenol Openeye Name: 2-bromo-4-(9-bromo-2,3-dimethyl-benzo[f]benzothiophen-4-yl)-6-ethyl-phenol CAS Name: 2-bromo-4-(9-bromo-2,3-dimethyl-4-benzo[f][1]benzothiolyl)-6-ethylphenol IUPAC Name: 2-bromo-4-(9-bromo-2,3-dimethylbenzo[f][1]benzothiol-4-yl)-6-ethylphenol Traditional Name: 2-bromo-4-(9-bromo-2,3-dimethyl-benzo[f]benzothiophen-4-yl)-6-ethyl-phenol Formula: C22H18Br2OS MolecularWeight: 490.25072

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1)C2=C3C(=C(SC3=C(C4=CC=CC=C42)Br)C)C)Br)O

Isomeric SMILES

CCC1=C(C(=CC(=C1)C2=C3C(=C(SC3=C(C4=CC=CC=C42)Br)C)C)Br)O

InChI

InChI=1S/C22H18Br2OS/c1-4-13-9-14(10-17(23)21(13)25)19-15-7-5-6-8-16(15)20(24)22-18(19)11(2)12(3)26-22/h5-10,25H,4H2,1-3H3