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

Systemtic Name: 4-[(2-bromanyl-4-methyl-1,3-benzothiazol-5-yl)carbonyl]-2-propan-2-yl-1H-pyrazol-3-one Openeye Name: 4-(2-bromo-4-methyl-1,3-benzothiazole-5-carbonyl)-2-isopropyl-1H-pyrazol-3-one CAS Name: 4-[(2-bromo-4-methyl-1,3-benzothiazol-5-yl)-oxomethyl]-2-propan-2-yl-1H-pyrazol-3-one IUPAC Name: 4-(2-bromo-4-methyl-1,3-benzothiazole-5-carbonyl)-2-propan-2-yl-1H-pyrazol-3-one Traditional Name: 4-(2-bromo-4-methyl-1,3-benzothiazole-5-carbonyl)-2-isopropyl-3-pyrazolin-3-one Formula: C15H14BrN3O2S MolecularWeight: 380.25956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14BrN3O2S/c1-7(2)19-14(21)10(6-17-19)13(20)9-4-5-11-12(8(9)3)18-15(16)22-11/h4-7,17H,1-3H3