2-(1,3-benzothiazol-2-yl)-4-[1-[(4-fluorophenyl)methylamino]ethylidene]-5-phenyl-pyrazol-3-one

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-4-[1-[(4-fluorophenyl)methylamino]ethylidene]-5-phenyl-pyrazol-3-one Openeye Name: 2-(1,3-benzothiazol-2-yl)-4-[1-[(4-fluorophenyl)methylamino]ethylidene]-5-phenyl-pyrazol-3-one CAS Name: 2-(1,3-benzothiazol-2-yl)-4-[1-[(4-fluorophenyl)methylamino]ethylidene]-5-phenyl-3-pyrazolone IUPAC Name: 2-(1,3-benzothiazol-2-yl)-4-[1-[(4-fluorophenyl)methylamino]ethylidene]-5-phenylpyrazol-3-one Traditional Name: 2-(1,3-benzothiazol-2-yl)-4-[1-[(4-fluorobenzyl)amino]ethylidene]-5-phenyl-2-pyrazolin-3-one Formula: C25H19FN4OS MolecularWeight: 442.507963

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C4=CC=CC=C4)NCC5=CC=C(C=C5)F

Isomeric SMILES

CC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C4=CC=CC=C4)NCC5=CC=C(C=C5)F

InChI

InChI=1S/C25H19FN4OS/c1-16(27-15-17-11-13-19(26)14-12-17)22-23(18-7-3-2-4-8-18)29-30(24(22)31)25-28-20-9-5-6-10-21(20)32-25/h2-14,27H,15H2,1H3