(4E)-4-(3-ethyl-5-methoxy-1,3-benzothiazol-2-ylidene)-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: (4E)-4-(3-ethyl-5-methoxy-1,3-benzothiazol-2-ylidene)-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-(3-ethyl-5-methoxy-1,3-benzothiazol-2-ylidene)-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-(3-ethyl-5-methoxy-1,3-benzothiazol-2-ylidene)-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-(3-ethyl-5-methoxy-1,3-benzothiazol-2-ylidene)-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-(3-ethyl-5-methoxy-1,3-benzothiazol-2-ylidene)-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)OC)SC1=C3C(=NN(C3=O)C4=CC=CC=C4)C

Isomeric SMILES

CCN\1C2=C(C=CC(=C2)OC)S/C1=C/3\C(=NN(C3=O)C4=CC=CC=C4)C

InChI

InChI=1S/C20H19N3O2S/c1-4-22-16-12-15(25-3)10-11-17(16)26-20(22)18-13(2)21-23(19(18)24)14-8-6-5-7-9-14/h5-12H,4H2,1-3H3/b20-18+