4-[[[2-[(3-fluorophenyl)amino]-1,3-thiazol-5-yl]methylamino]methyl]-2H-phthalazin-1-one

Systemtic Name: 4-[[[2-[(3-fluorophenyl)amino]-1,3-thiazol-5-yl]methylamino]methyl]-2H-phthalazin-1-one Openeye Name: 4-[[[2-(3-fluoroanilino)thiazol-5-yl]methylamino]methyl]-2H-phthalazin-1-one CAS Name: 4-[[[2-(3-fluoroanilino)-5-thiazolyl]methylamino]methyl]-2H-phthalazin-1-one IUPAC Name: 4-[[[2-(3-fluoroanilino)-1,3-thiazol-5-yl]methylamino]methyl]-2H-phthalazin-1-one Traditional Name: 4-[[[2-(3-fluoroanilino)thiazol-5-yl]methylamino]methyl]-2H-phthalazin-1-one Formula: C19H16FN5OS MolecularWeight: 381.426643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)CNCC3=CN=C(S3)NC4=CC(=CC=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)CNCC3=CN=C(S3)NC4=CC(=CC=C4)F

InChI

InChI=1S/C19H16FN5OS/c20-12-4-3-5-13(8-12)23-19-22-10-14(27-19)9-21-11-17-15-6-1-2-7-16(15)18(26)25-24-17/h1-8,10,21H,9,11H2,(H,22,23)(H,25,26)