7-methyl-4-(7-methyl-9,9-dioctyl-fluoren-2-yl)-1,3-dihydro-2,1,3-benzothiadiazole

Systemtic Name: 7-methyl-4-(7-methyl-9,9-dioctyl-fluoren-2-yl)-1,3-dihydro-2,1,3-benzothiadiazole Openeye Name: 7-methyl-4-(7-methyl-9,9-dioctyl-fluoren-2-yl)-1,3-dihydro-2,1,3-benzothiadiazole CAS Name: 7-methyl-4-(7-methyl-9,9-dioctyl-2-fluorenyl)-1,3-dihydro-2,1,3-benzothiadiazole IUPAC Name: 7-methyl-4-(7-methyl-9,9-dioctylfluoren-2-yl)-1,3-dihydro-2,1,3-benzothiadiazole Traditional Name: 4-methyl-7-(7-methyl-9,9-dioctyl-fluoren-2-yl)-1,3-dihydropiazthiole Formula: C37H50N2S MolecularWeight: 554.8713

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1(C2=C(C=CC(=C2)C)C3=C1C=C(C=C3)C4=C5C(=C(C=C4)C)NSN5)CCCCCCCC

Isomeric SMILES

CCCCCCCCC1(C2=C(C=CC(=C2)C)C3=C1C=C(C=C3)C4=C5C(=C(C=C4)C)NSN5)CCCCCCCC

InChI

InChI=1S/C37H50N2S/c1-5-7-9-11-13-15-23-37(24-16-14-12-10-8-6-2)33-25-27(3)17-20-31(33)32-22-19-29(26-34(32)37)30-21-18-28(4)35-36(30)39-40-38-35/h17-22,25-26,38-39H,5-16,23-24H2,1-4H3