9-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]butyl]-N-propyl-fluorene-9-carboxamide

Systemtic Name: 9-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]butyl]-N-propyl-fluorene-9-carboxamide Openeye Name: 9-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]butyl]-N-propyl-fluorene-9-carboxamide CAS Name: 9-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]butyl]-N-propyl-9-fluorenecarboxamide IUPAC Name: 9-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]butyl]-N-propylfluorene-9-carboxamide Traditional Name: 9-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]butyl]-N-propyl-fluorene-9-carboxamide Formula: C30H32N2O2S2 MolecularWeight: 516.71728

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1(C2=CC=CC=C2C3=CC=CC=C31)CCCCSC4=NC5=C(S4)C=C(C=C5)OCC

Isomeric SMILES

CCCNC(=O)C1(C2=CC=CC=C2C3=CC=CC=C31)CCCCSC4=NC5=C(S4)C=C(C=C5)OCC

InChI

InChI=1S/C30H32N2O2S2/c1-3-18-31-28(33)30(24-13-7-5-11-22(24)23-12-6-8-14-25(23)30)17-9-10-19-35-29-32-26-16-15-21(34-4-2)20-27(26)36-29/h5-8,11-16,20H,3-4,9-10,17-19H2,1-2H3,(H,31,33)