4-cyclopropylcarbonyl-N-(3-fluoranyl-4-methyl-phenyl)piperazine-1-carbothioamide

Systemtic Name: 4-cyclopropylcarbonyl-N-(3-fluoranyl-4-methyl-phenyl)piperazine-1-carbothioamide Openeye Name: 4-(cyclopropanecarbonyl)-N-(3-fluoro-4-methyl-phenyl)piperazine-1-carbothioamide CAS Name: 4-[cyclopropyl(oxo)methyl]-N-(3-fluoro-4-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(cyclopropanecarbonyl)-N-(3-fluoro-4-methylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(cyclopropanecarbonyl)-N-(3-fluoro-4-methyl-phenyl)piperazine-1-carbothioamide Formula: C16H20FN3OS MolecularWeight: 321.412903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N2CCN(CC2)C(=O)C3CC3)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N2CCN(CC2)C(=O)C3CC3)F

InChI

InChI=1S/C16H20FN3OS/c1-11-2-5-13(10-14(11)17)18-16(22)20-8-6-19(7-9-20)15(21)12-3-4-12/h2,5,10,12H,3-4,6-9H2,1H3,(H,18,22)