4-butoxy-N-[2-[(2-fluorophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 4-butoxy-N-[2-[(2-fluorophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]benzamide Openeye Name: 4-butoxy-N-[2-[(2-fluorophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]benzamide CAS Name: 4-butoxy-N-[2-[(2-fluorophenyl)methylthio]-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 4-butoxy-N-[2-[(2-fluorophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]benzamide Traditional Name: 4-butoxy-N-[2-[(2-fluorobenzyl)thio]-1,3-benzothiazol-6-yl]benzamide Formula: C25H23FN2O2S2 MolecularWeight: 466.590723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=CC=CC=C4F

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=CC=CC=C4F

InChI

InChI=1S/C25H23FN2O2S2/c1-2-3-14-30-20-11-8-17(9-12-20)24(29)27-19-10-13-22-23(15-19)32-25(28-22)31-16-18-6-4-5-7-21(18)26/h4-13,15H,2-3,14,16H2,1H3,(H,27,29)