tert-butyl N-[3-bromanyl-5-(9-bromanyl-2,3-dimethyl-benzo[f][1]benzothiol-4-yl)-2-oxidanyl-phenyl]carbamate

Systemtic Name: tert-butyl N-[3-bromanyl-5-(9-bromanyl-2,3-dimethyl-benzo[f][1]benzothiol-4-yl)-2-oxidanyl-phenyl]carbamate Openeye Name: tert-butyl N-[3-bromo-5-(9-bromo-2,3-dimethyl-benzo[f]benzothiophen-4-yl)-2-hydroxy-phenyl]carbamate CAS Name: N-[3-bromo-5-(9-bromo-2,3-dimethyl-4-benzo[f][1]benzothiolyl)-2-hydroxyphenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-bromo-5-(9-bromo-2,3-dimethylbenzo[f][1]benzothiol-4-yl)-2-hydroxyphenyl]carbamate Traditional Name: N-[3-bromo-5-(9-bromo-2,3-dimethyl-benzo[f]benzothiophen-4-yl)-2-hydroxy-phenyl]carbamic acid tert-butyl ester Formula: C25H23Br2NO3S MolecularWeight: 577.32802

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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)NC(=O)OC(C)(C)C)Br)C

Isomeric SMILES

CC1=C(SC2=C(C3=CC=CC=C3C(=C12)C4=CC(=C(C(=C4)Br)O)NC(=O)OC(C)(C)C)Br)C

InChI

InChI=1S/C25H23Br2NO3S/c1-12-13(2)32-23-19(12)20(15-8-6-7-9-16(15)21(23)27)14-10-17(26)22(29)18(11-14)28-24(30)31-25(3,4)5/h6-11,29H,1-5H3,(H,28,30)