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

Systemtic Name: (4E)-2-(1,3-benzothiazol-2-yl)-4-[(2-hydroxyethylamino)methylidene]-5-phenyl-pyrazol-3-one Openeye Name: (4E)-2-(1,3-benzothiazol-2-yl)-4-[(2-hydroxyethylamino)methylene]-5-phenyl-pyrazol-3-one CAS Name: (4E)-2-(1,3-benzothiazol-2-yl)-4-[(2-hydroxyethylamino)methylidene]-5-phenyl-3-pyrazolone IUPAC Name: (4E)-2-(1,3-benzothiazol-2-yl)-4-[(2-hydroxyethylamino)methylidene]-5-phenylpyrazol-3-one Traditional Name: (4E)-2-(1,3-benzothiazol-2-yl)-4-[(2-hydroxyethylamino)methylene]-5-phenyl-2-pyrazolin-3-one Formula: C19H16N4O2S MolecularWeight: 364.42094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=O)C2=CNCCO)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)C\2=NN(C(=O)/C2=C/NCCO)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H16N4O2S/c24-11-10-20-12-14-17(13-6-2-1-3-7-13)22-23(18(14)25)19-21-15-8-4-5-9-16(15)26-19/h1-9,12,20,24H,10-11H2/b14-12+