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

Systemtic Name: 4-[(4-methyl-2-propan-2-yl-1,3-benzothiazol-5-yl)carbonyl]-2-propan-2-yl-1H-pyrazol-3-one Openeye Name: 2-isopropyl-4-(2-isopropyl-4-methyl-1,3-benzothiazole-5-carbonyl)-1H-pyrazol-3-one CAS Name: 4-[(4-methyl-2-propan-2-yl-1,3-benzothiazol-5-yl)-oxomethyl]-2-propan-2-yl-1H-pyrazol-3-one IUPAC Name: 4-(4-methyl-2-propan-2-yl-1,3-benzothiazole-5-carbonyl)-2-propan-2-yl-1H-pyrazol-3-one Traditional Name: 2-isopropyl-4-(2-isopropyl-4-methyl-1,3-benzothiazole-5-carbonyl)-3-pyrazolin-3-one Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C18H21N3O2S/c1-9(2)17-20-15-11(5)12(6-7-14(15)24-17)16(22)13-8-19-21(10(3)4)18(13)23/h6-10,19H,1-5H3