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

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carbothioamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-4-[(5-methylisoxazol-3-yl)methyl]piperazine-1-carbothioamide CAS Name: N-(3-chloro-4-fluorophenyl)-4-[(5-methyl-3-isoxazolyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carbothioamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-4-[(5-methylisoxazol-3-yl)methyl]piperazine-1-carbothioamide Formula: C16H18ClFN4OS MolecularWeight: 368.856723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CN2CCN(CC2)C(=S)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1=CC(=NO1)CN2CCN(CC2)C(=S)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C16H18ClFN4OS/c1-11-8-13(20-23-11)10-21-4-6-22(7-5-21)16(24)19-12-2-3-15(18)14(17)9-12/h2-3,8-9H,4-7,10H2,1H3,(H,19,24)