N-[2,4-bis(fluoranyl)phenyl]-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-[2,4-bis(fluoranyl)phenyl]-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-(2,4-difluorophenyl)-4-(o-tolylmethyl)piperazine-1-carbothioamide CAS Name: N-(2,4-difluorophenyl)-4-[(2-methylphenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(2,4-difluorophenyl)-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide Traditional Name: N-(2,4-difluorophenyl)-4-(2-methylbenzyl)piperazine-1-carbothioamide Formula: C19H21F2N3S MolecularWeight: 361.451946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=S)NC3=C(C=C(C=C3)F)F

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=S)NC3=C(C=C(C=C3)F)F

InChI

InChI=1S/C19H21F2N3S/c1-14-4-2-3-5-15(14)13-23-8-10-24(11-9-23)19(25)22-18-7-6-16(20)12-17(18)21/h2-7,12H,8-11,13H2,1H3,(H,22,25)