[4-oxidanylidene-3-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]phthalazin-1-yl] ethanoate

Systemtic Name: [4-oxidanylidene-3-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]phthalazin-1-yl] ethanoate Openeye Name: [4-oxo-3-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]phthalazin-1-yl] acetate CAS Name: acetic acid [4-oxo-3-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]-1-phthalazinyl] ester IUPAC Name: [4-oxo-3-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]phthalazin-1-yl] acetate Traditional Name: acetic acid [4-keto-3-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]phthalazin-1-yl] ester Formula: C18H10F3N3O3S MolecularWeight: 405.35051

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=NN(C(=O)C2=CC=CC=C21)C3=NC4=C(S3)C=CC(=C4)C(F)(F)F

Isomeric SMILES

CC(=O)OC1=NN(C(=O)C2=CC=CC=C21)C3=NC4=C(S3)C=CC(=C4)C(F)(F)F

InChI

InChI=1S/C18H10F3N3O3S/c1-9(25)27-15-11-4-2-3-5-12(11)16(26)24(23-15)17-22-13-8-10(18(19,20)21)6-7-14(13)28-17/h2-8H,1H3