2-(1,3-benzothiazol-2-yl)-4-[1-[(5-methyl-2-oxidanyl-phenyl)amino]ethylidene]-5-phenyl-pyrazol-3-one

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-4-[1-[(5-methyl-2-oxidanyl-phenyl)amino]ethylidene]-5-phenyl-pyrazol-3-one Openeye Name: 2-(1,3-benzothiazol-2-yl)-4-[1-(2-hydroxy-5-methyl-anilino)ethylidene]-5-phenyl-pyrazol-3-one CAS Name: 2-(1,3-benzothiazol-2-yl)-4-[1-(2-hydroxy-5-methylanilino)ethylidene]-5-phenyl-3-pyrazolone IUPAC Name: 2-(1,3-benzothiazol-2-yl)-4-[1-(2-hydroxy-5-methylanilino)ethylidene]-5-phenylpyrazol-3-one Traditional Name: 2-(1,3-benzothiazol-2-yl)-4-[1-(2-hydroxy-5-methyl-anilino)ethylidene]-5-phenyl-2-pyrazolin-3-one Formula: C25H20N4O2S MolecularWeight: 440.5169

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)NC(=C2C(=NN(C2=O)C3=NC4=CC=CC=C4S3)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=C(C=C1)O)NC(=C2C(=NN(C2=O)C3=NC4=CC=CC=C4S3)C5=CC=CC=C5)C

InChI

InChI=1S/C25H20N4O2S/c1-15-12-13-20(30)19(14-15)26-16(2)22-23(17-8-4-3-5-9-17)28-29(24(22)31)25-27-18-10-6-7-11-21(18)32-25/h3-14,26,30H,1-2H3