3-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-fluoranyl-4-methyl-phenyl)propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-fluoranyl-4-methyl-phenyl)propanamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-fluoro-4-methyl-phenyl)propanamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-(3-fluoro-4-methylphenyl)propanamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-fluoro-4-methylphenyl)propanamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-(3-fluoro-4-methyl-phenyl)propionamide Formula: C17H15FN2OS2 MolecularWeight: 346.442203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCSC2=NC3=CC=CC=C3S2)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCSC2=NC3=CC=CC=C3S2)F

InChI

InChI=1S/C17H15FN2OS2/c1-11-6-7-12(10-13(11)18)19-16(21)8-9-22-17-20-14-4-2-3-5-15(14)23-17/h2-7,10H,8-9H2,1H3,(H,19,21)