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

Systemtic Name: 4-[(2-ethyl-4-methyl-1,3-benzothiazol-5-yl)carbonyl]-2-propan-2-yl-1H-pyrazol-3-one Openeye Name: 4-(2-ethyl-4-methyl-1,3-benzothiazole-5-carbonyl)-2-isopropyl-1H-pyrazol-3-one CAS Name: 4-[(2-ethyl-4-methyl-1,3-benzothiazol-5-yl)-oxomethyl]-2-propan-2-yl-1H-pyrazol-3-one IUPAC Name: 4-(2-ethyl-4-methyl-1,3-benzothiazole-5-carbonyl)-2-propan-2-yl-1H-pyrazol-3-one Traditional Name: 4-(2-ethyl-4-methyl-1,3-benzothiazole-5-carbonyl)-2-isopropyl-3-pyrazolin-3-one Formula: C17H19N3O2S MolecularWeight: 329.41666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(S1)C=CC(=C2C)C(=O)C3=CNN(C3=O)C(C)C

Isomeric SMILES

CCC1=NC2=C(S1)C=CC(=C2C)C(=O)C3=CNN(C3=O)C(C)C

InChI

InChI=1S/C17H19N3O2S/c1-5-14-19-15-10(4)11(6-7-13(15)23-14)16(21)12-8-18-20(9(2)3)17(12)22/h6-9,18H,5H2,1-4H3