4-[(2-tert-butyl-4-methyl-1,3-benzothiazol-5-yl)carbonyl]-2-propan-2-yl-1H-pyrazol-3-one

Systemtic Name: 4-[(2-tert-butyl-4-methyl-1,3-benzothiazol-5-yl)carbonyl]-2-propan-2-yl-1H-pyrazol-3-one Openeye Name: 4-(2-tert-butyl-4-methyl-1,3-benzothiazole-5-carbonyl)-2-isopropyl-1H-pyrazol-3-one CAS Name: 4-[(2-tert-butyl-4-methyl-1,3-benzothiazol-5-yl)-oxomethyl]-2-propan-2-yl-1H-pyrazol-3-one IUPAC Name: 4-(2-tert-butyl-4-methyl-1,3-benzothiazole-5-carbonyl)-2-propan-2-yl-1H-pyrazol-3-one Traditional Name: 4-(2-tert-butyl-4-methyl-1,3-benzothiazole-5-carbonyl)-2-isopropyl-3-pyrazolin-3-one Formula: C19H23N3O2S MolecularWeight: 357.46982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(S2)C(C)(C)C)C(=O)C3=CNN(C3=O)C(C)C

Isomeric SMILES

CC1=C(C=CC2=C1N=C(S2)C(C)(C)C)C(=O)C3=CNN(C3=O)C(C)C

InChI

InChI=1S/C19H23N3O2S/c1-10(2)22-17(24)13(9-20-22)16(23)12-7-8-14-15(11(12)3)21-18(25-14)19(4,5)6/h7-10,20H,1-6H3