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

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-5-(4-methylphenyl)-1H-pyrazol-3-one Openeye Name: 2-(1,3-benzothiazol-2-yl)-5-(p-tolyl)-1H-pyrazol-3-one CAS Name: 2-(1,3-benzothiazol-2-yl)-5-(4-methylphenyl)-1H-pyrazol-3-one IUPAC Name: 2-(1,3-benzothiazol-2-yl)-5-(4-methylphenyl)-1H-pyrazol-3-one Traditional Name: 2-(1,3-benzothiazol-2-yl)-5-(p-tolyl)-3-pyrazolin-3-one Formula: C17H13N3OS MolecularWeight: 307.36962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=O)N(N2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=O)N(N2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H13N3OS/c1-11-6-8-12(9-7-11)14-10-16(21)20(19-14)17-18-13-4-2-3-5-15(13)22-17/h2-10,19H,1H3