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

Systemtic Name: N-[2-[(4-fluoranylnaphthalen-1-yl)methylsulfanyl]-1,3-benzothiazol-6-yl]propanamide Openeye Name: N-[2-[(4-fluoro-1-naphthyl)methylsulfanyl]-1,3-benzothiazol-6-yl]propanamide CAS Name: N-[2-[(4-fluoro-1-naphthalenyl)methylthio]-1,3-benzothiazol-6-yl]propanamide IUPAC Name: N-[2-[(4-fluoronaphthalen-1-yl)methylsulfanyl]-1,3-benzothiazol-6-yl]propanamide Traditional Name: N-[2-[(4-fluoro-1-naphthyl)methylthio]-1,3-benzothiazol-6-yl]propionamide Formula: C21H17FN2OS2 MolecularWeight: 396.500883

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC3=CC=C(C4=CC=CC=C34)F

Isomeric SMILES

CCC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC3=CC=C(C4=CC=CC=C34)F

InChI

InChI=1S/C21H17FN2OS2/c1-2-20(25)23-14-8-10-18-19(11-14)27-21(24-18)26-12-13-7-9-17(22)16-6-4-3-5-15(13)16/h3-11H,2,12H2,1H3,(H,23,25)