4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(3-fluoranyl-4-methyl-phenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(3-fluoranyl-4-methyl-phenyl)piperazine-1-carbothioamide Openeye Name: 4-(3,5-dimethylisoxazol-4-yl)sulfonyl-N-(3-fluoro-4-methyl-phenyl)piperazine-1-carbothioamide CAS Name: 4-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-N-(3-fluoro-4-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(3-fluoro-4-methylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(3,5-dimethylisoxazol-4-yl)sulfonyl-N-(3-fluoro-4-methyl-phenyl)piperazine-1-carbothioamide Formula: C17H21FN4O3S2 MolecularWeight: 412.502043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N2CCN(CC2)S(=O)(=O)C3=C(ON=C3C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N2CCN(CC2)S(=O)(=O)C3=C(ON=C3C)C)F

InChI

InChI=1S/C17H21FN4O3S2/c1-11-4-5-14(10-15(11)18)19-17(26)21-6-8-22(9-7-21)27(23,24)16-12(2)20-25-13(16)3/h4-5,10H,6-9H2,1-3H3,(H,19,26)