(4E)-4-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: (4E)-4-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-[[5-(1,3-benzothiazol-2-yl)-2-furanyl]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methylene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C22H15N3O2S MolecularWeight: 385.4384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(O2)C3=NC4=CC=CC=C4S3)C5=CC=CC=C5

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC=C(O2)C3=NC4=CC=CC=C4S3)C5=CC=CC=C5

InChI

InChI=1S/C22H15N3O2S/c1-14-17(22(26)25(24-14)15-7-3-2-4-8-15)13-16-11-12-19(27-16)21-23-18-9-5-6-10-20(18)28-21/h2-13H,1H3/b17-13+