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

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-5-propan-2-yl-4H-pyrazol-3-one Openeye Name: 2-(1,3-benzothiazol-2-yl)-5-isopropyl-4H-pyrazol-3-one CAS Name: 2-(1,3-benzothiazol-2-yl)-5-propan-2-yl-4H-pyrazol-3-one IUPAC Name: 2-(1,3-benzothiazol-2-yl)-5-propan-2-yl-4H-pyrazol-3-one Traditional Name: 2-(1,3-benzothiazol-2-yl)-5-isopropyl-2-pyrazolin-3-one Formula: C13H13N3OS MolecularWeight: 259.32682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C(=O)C1)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)C1=NN(C(=O)C1)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H13N3OS/c1-8(2)10-7-12(17)16(15-10)13-14-9-5-3-4-6-11(9)18-13/h3-6,8H,7H2,1-2H3