1-[5-methyl-3-oxidanylidene-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]butane-1,3-dione

Systemtic Name: 1-[5-methyl-3-oxidanylidene-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]butane-1,3-dione Openeye Name: 1-[5-methyl-3-oxo-2-(4-phenylthiazol-2-yl)-1H-pyrazol-4-yl]butane-1,3-dione CAS Name: 1-[5-methyl-3-oxo-2-(4-phenyl-2-thiazolyl)-1H-pyrazol-4-yl]butane-1,3-dione IUPAC Name: 1-[5-methyl-3-oxo-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]butane-1,3-dione Traditional Name: 1-[5-keto-3-methyl-1-(4-phenylthiazol-2-yl)-3-pyrazolin-4-yl]butane-1,3-dione Formula: C17H15N3O3S MolecularWeight: 341.3843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=NC(=CS2)C3=CC=CC=C3)C(=O)CC(=O)C

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=NC(=CS2)C3=CC=CC=C3)C(=O)CC(=O)C

InChI

InChI=1S/C17H15N3O3S/c1-10(21)8-14(22)15-11(2)19-20(16(15)23)17-18-13(9-24-17)12-6-4-3-5-7-12/h3-7,9,19H,8H2,1-2H3