4-tert-butyl-N-[2-[(4-fluoranylnaphthalen-1-yl)methylsulfanyl]-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-[(4-fluoranylnaphthalen-1-yl)methylsulfanyl]-1,3-benzothiazol-6-yl]benzamide Openeye Name: 4-tert-butyl-N-[2-[(4-fluoro-1-naphthyl)methylsulfanyl]-1,3-benzothiazol-6-yl]benzamide CAS Name: 4-tert-butyl-N-[2-[(4-fluoro-1-naphthalenyl)methylthio]-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 4-tert-butyl-N-[2-[(4-fluoronaphthalen-1-yl)methylsulfanyl]-1,3-benzothiazol-6-yl]benzamide Traditional Name: 4-tert-butyl-N-[2-[(4-fluoro-1-naphthyl)methylthio]-1,3-benzothiazol-6-yl]benzamide Formula: C29H25FN2OS2 MolecularWeight: 500.650003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=CC=C(C5=CC=CC=C45)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=CC=C(C5=CC=CC=C45)F

InChI

InChI=1S/C29H25FN2OS2/c1-29(2,3)20-11-8-18(9-12-20)27(33)31-21-13-15-25-26(16-21)35-28(32-25)34-17-19-10-14-24(30)23-7-5-4-6-22(19)23/h4-16H,17H2,1-3H3,(H,31,33)