N-(4-fluoranyl-1,3-benzothiazol-2-yl)-2-phenylsulfanyl-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: N-(4-fluoranyl-1,3-benzothiazol-2-yl)-2-phenylsulfanyl-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-2-phenylsulfanyl-N-(3-pyridylmethyl)acetamide CAS Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-2-(phenylthio)-N-(3-pyridinylmethyl)acetamide IUPAC Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-2-phenylsulfanyl-N-(pyridin-3-ylmethyl)acetamide Traditional Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-2-(phenylthio)-N-(3-pyridylmethyl)acetamide Formula: C21H16FN3OS2 MolecularWeight: 409.499643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(=O)N(CC2=CN=CC=C2)C3=NC4=C(C=CC=C4S3)F

Isomeric SMILES

C1=CC=C(C=C1)SCC(=O)N(CC2=CN=CC=C2)C3=NC4=C(C=CC=C4S3)F

InChI

InChI=1S/C21H16FN3OS2/c22-17-9-4-10-18-20(17)24-21(28-18)25(13-15-6-5-11-23-12-15)19(26)14-27-16-7-2-1-3-8-16/h1-12H,13-14H2