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

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-2-phthalazin-1-ylsulfanyl-propanamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-2-phthalazin-1-ylsulfanyl-propanamide CAS Name: N-(3-fluoro-4-methylphenyl)-2-(1-phthalazinylthio)propanamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-2-phthalazin-1-ylsulfanylpropanamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-2-(phthalazin-1-ylthio)propionamide Formula: C18H16FN3OS MolecularWeight: 341.402543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NN=CC3=CC=CC=C32)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NN=CC3=CC=CC=C32)F

InChI

InChI=1S/C18H16FN3OS/c1-11-7-8-14(9-16(11)19)21-17(23)12(2)24-18-15-6-4-3-5-13(15)10-20-22-18/h3-10,12H,1-2H3,(H,21,23)