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

Systemtic Name: 4-[(2-cyclopropyl-4-methyl-1,3-benzothiazol-5-yl)carbonyl]-2-propan-2-yl-1H-pyrazol-3-one Openeye Name: 4-(2-cyclopropyl-4-methyl-1,3-benzothiazole-5-carbonyl)-2-isopropyl-1H-pyrazol-3-one CAS Name: 4-[(2-cyclopropyl-4-methyl-1,3-benzothiazol-5-yl)-oxomethyl]-2-propan-2-yl-1H-pyrazol-3-one IUPAC Name: 4-(2-cyclopropyl-4-methyl-1,3-benzothiazole-5-carbonyl)-2-propan-2-yl-1H-pyrazol-3-one Traditional Name: 4-(2-cyclopropyl-4-methyl-1,3-benzothiazole-5-carbonyl)-2-isopropyl-3-pyrazolin-3-one Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(S2)C3CC3)C(=O)C4=CNN(C4=O)C(C)C

Isomeric SMILES

CC1=C(C=CC2=C1N=C(S2)C3CC3)C(=O)C4=CNN(C4=O)C(C)C

InChI

InChI=1S/C18H19N3O2S/c1-9(2)21-18(23)13(8-19-21)16(22)12-6-7-14-15(10(12)3)20-17(24-14)11-4-5-11/h6-9,11,19H,4-5H2,1-3H3