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

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-4-(4-fluorophenyl)piperazine-1-carbothioamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-4-(4-fluorophenyl)piperazine-1-carbothioamide CAS Name: N-(3-fluoro-4-methylphenyl)-4-(4-fluorophenyl)-1-piperazinecarbothioamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-4-(4-fluorophenyl)piperazine-1-carbothioamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-4-(4-fluorophenyl)piperazine-1-carbothioamide Formula: C18H19F2N3S MolecularWeight: 347.425366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19F2N3S/c1-13-2-5-15(12-17(13)20)21-18(24)23-10-8-22(9-11-23)16-6-3-14(19)4-7-16/h2-7,12H,8-11H2,1H3,(H,21,24)