9-[4-[(6-azanyl-1,3-benzothiazol-2-yl)sulfanyl]butyl]-N-(pyridin-2-ylmethyl)fluorene-9-carboxamide

Systemtic Name: 9-[4-[(6-azanyl-1,3-benzothiazol-2-yl)sulfanyl]butyl]-N-(pyridin-2-ylmethyl)fluorene-9-carboxamide Openeye Name: 9-[4-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]butyl]-N-(2-pyridylmethyl)fluorene-9-carboxamide CAS Name: 9-[4-[(6-amino-1,3-benzothiazol-2-yl)thio]butyl]-N-(2-pyridinylmethyl)-9-fluorenecarboxamide IUPAC Name: 9-[4-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]butyl]-N-(pyridin-2-ylmethyl)fluorene-9-carboxamide Traditional Name: 9-[4-[(6-amino-1,3-benzothiazol-2-yl)thio]butyl]-N-(2-pyridylmethyl)fluorene-9-carboxamide Formula: C31H28N4OS2 MolecularWeight: 536.71022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=CC=CC=C3C2(CCCCSC4=NC5=C(S4)C=C(C=C5)N)C(=O)NCC6=CC=CC=N6

Isomeric SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3C2(CCCCSC4=NC5=C(S4)C=C(C=C5)N)C(=O)NCC6=CC=CC=N6

InChI

InChI=1S/C31H28N4OS2/c32-21-14-15-27-28(19-21)38-30(35-27)37-18-8-6-16-31(29(36)34-20-22-9-5-7-17-33-22)25-12-3-1-10-23(25)24-11-2-4-13-26(24)31/h1-5,7,9-15,17,19H,6,8,16,18,20,32H2,(H,34,36)