1-butyl-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-propyl-9H-fluorene-9-carboxamide

Systemtic Name: 1-butyl-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-propyl-9H-fluorene-9-carboxamide Openeye Name: 1-butyl-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-propyl-9H-fluorene-9-carboxamide CAS Name: 1-butyl-2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]-N-propyl-9H-fluorene-9-carboxamide IUPAC Name: 1-butyl-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-propyl-9H-fluorene-9-carboxamide Traditional Name: 1-butyl-2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]-N-propyl-9H-fluorene-9-carboxamide Formula: C30H32N2O2S2 MolecularWeight: 516.71728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC2=C1C(C3=CC=CC=C23)C(=O)NCCC)SC4=NC5=C(S4)C=C(C=C5)OCC

Isomeric SMILES

CCCCC1=C(C=CC2=C1C(C3=CC=CC=C23)C(=O)NCCC)SC4=NC5=C(S4)C=C(C=C5)OCC

InChI

InChI=1S/C30H32N2O2S2/c1-4-7-10-23-25(35-30-32-24-15-13-19(34-6-3)18-26(24)36-30)16-14-22-20-11-8-9-12-21(20)28(27(22)23)29(33)31-17-5-2/h8-9,11-16,18,28H,4-7,10,17H2,1-3H3,(H,31,33)