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

Systemtic Name: N-[2-[(4-fluoranylnaphthalen-1-yl)methylsulfanyl]-1,3-benzothiazol-6-yl]-3-phenyl-prop-2-enamide Openeye Name: N-[2-[(4-fluoro-1-naphthyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-3-phenyl-prop-2-enamide CAS Name: N-[2-[(4-fluoro-1-naphthalenyl)methylthio]-1,3-benzothiazol-6-yl]-3-phenyl-2-propenamide IUPAC Name: N-[2-[(4-fluoronaphthalen-1-yl)methylsulfanyl]-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide Traditional Name: N-[2-[(4-fluoro-1-naphthyl)methylthio]-1,3-benzothiazol-6-yl]-3-phenyl-acrylamide Formula: C27H19FN2OS2 MolecularWeight: 470.580963

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H19FN2OS2/c28-23-13-11-19(21-8-4-5-9-22(21)23)17-32-27-30-24-14-12-20(16-25(24)33-27)29-26(31)15-10-18-6-2-1-3-7-18/h1-16H,17H2,(H,29,31)