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

Systemtic Name: 2,6-bis(bromanyl)-4-(2,3-dimethyl-9-phenylsulfanyl-benzo[f][1]benzothiol-4-yl)phenol Openeye Name: 2,6-dibromo-4-(2,3-dimethyl-9-phenylsulfanyl-benzo[f]benzothiophen-4-yl)phenol CAS Name: 2,6-dibromo-4-[2,3-dimethyl-9-(phenylthio)-4-benzo[f][1]benzothiolyl]phenol IUPAC Name: 2,6-dibromo-4-(2,3-dimethyl-9-phenylsulfanylbenzo[f][1]benzothiol-4-yl)phenol Traditional Name: 2,6-dibromo-4-[2,3-dimethyl-9-(phenylthio)benzo[f]benzothiophen-4-yl]phenol Formula: C26H18Br2OS2 MolecularWeight: 570.35852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C(C3=CC=CC=C3C(=C12)C4=CC(=C(C(=C4)Br)O)Br)SC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(SC2=C(C3=CC=CC=C3C(=C12)C4=CC(=C(C(=C4)Br)O)Br)SC5=CC=CC=C5)C

InChI

InChI=1S/C26H18Br2OS2/c1-14-15(2)30-26-22(14)23(16-12-20(27)24(29)21(28)13-16)18-10-6-7-11-19(18)25(26)31-17-8-4-3-5-9-17/h3-13,29H,1-2H3