4-oxidanylidene-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]-3H-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]-3H-phthalazine-1-carboxamide Openeye Name: 4-oxo-N-[5-[[3-(trifluoromethyl)phenyl]methyl]thiazol-2-yl]-3H-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-2-thiazolyl]-3H-phthalazine-1-carboxamide IUPAC Name: 4-oxo-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[5-[3-(trifluoromethyl)benzyl]thiazol-2-yl]-3H-phthalazine-1-carboxamide Formula: C20H13F3N4O2S MolecularWeight: 430.40303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NC3=NC=C(S3)CC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NC3=NC=C(S3)CC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C20H13F3N4O2S/c21-20(22,23)12-5-3-4-11(8-12)9-13-10-24-19(30-13)25-18(29)16-14-6-1-2-7-15(14)17(28)27-26-16/h1-8,10H,9H2,(H,27,28)(H,24,25,29)