4-(2,3-dimethylphenyl)-N-(3-fluoranyl-4-methyl-phenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(2,3-dimethylphenyl)-N-(3-fluoranyl-4-methyl-phenyl)piperazine-1-carbothioamide Openeye Name: 4-(2,3-dimethylphenyl)-N-(3-fluoro-4-methyl-phenyl)piperazine-1-carbothioamide CAS Name: 4-(2,3-dimethylphenyl)-N-(3-fluoro-4-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(2,3-dimethylphenyl)-N-(3-fluoro-4-methylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(2,3-dimethylphenyl)-N-(3-fluoro-4-methyl-phenyl)piperazine-1-carbothioamide Formula: C20H24FN3S MolecularWeight: 357.488063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=S)NC3=CC(=C(C=C3)C)F)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=S)NC3=CC(=C(C=C3)C)F)C

InChI

InChI=1S/C20H24FN3S/c1-14-5-4-6-19(16(14)3)23-9-11-24(12-10-23)20(25)22-17-8-7-15(2)18(21)13-17/h4-8,13H,9-12H2,1-3H3,(H,22,25)