2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)-4H-pyrazol-3-one

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)-4H-pyrazol-3-one Openeye Name: 2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)-4H-pyrazol-3-one CAS Name: 2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)-4H-pyrazol-3-one IUPAC Name: 2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)-4H-pyrazol-3-one Traditional Name: 2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)-2-pyrazolin-3-one Formula: C17H13N3O2S MolecularWeight: 323.36902

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=O)C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=O)C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H13N3O2S/c1-22-12-8-6-11(7-9-12)14-10-16(21)20(19-14)17-18-13-4-2-3-5-15(13)23-17/h2-9H,10H2,1H3