5-methyl-4-[(Z)-1-oxidanyl-3-oxidanylidene-but-1-enyl]-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-3-one

Systemtic Name: 5-methyl-4-[(Z)-1-oxidanyl-3-oxidanylidene-but-1-enyl]-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-3-one Openeye Name: 4-[(Z)-1-hydroxy-3-oxo-but-1-enyl]-5-methyl-2-(4-phenylthiazol-2-yl)-1H-pyrazol-3-one CAS Name: 4-[(Z)-1-hydroxy-3-oxobut-1-enyl]-5-methyl-2-(4-phenyl-2-thiazolyl)-1H-pyrazol-3-one IUPAC Name: 4-[(Z)-1-hydroxy-3-oxobut-1-enyl]-5-methyl-2-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-3-one Traditional Name: 4-[(Z)-1-hydroxy-3-keto-but-1-enyl]-5-methyl-2-(4-phenylthiazol-2-yl)-3-pyrazolin-3-one 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(=CC(=O)C)O

Isomeric SMILES

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

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/h3-9,19,22H,1-2H3/b14-8-