N-(3,5-dimethylphenyl)-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-(3,5-dimethylphenyl)-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-(3,5-dimethylphenyl)-4-(o-tolylmethyl)piperazine-1-carbothioamide CAS Name: N-(3,5-dimethylphenyl)-4-[(2-methylphenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(3,5-dimethylphenyl)-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide Traditional Name: N-(3,5-dimethylphenyl)-4-(2-methylbenzyl)piperazine-1-carbothioamide Formula: C21H27N3S MolecularWeight: 353.52418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3S/c1-16-12-17(2)14-20(13-16)22-21(25)24-10-8-23(9-11-24)15-19-7-5-4-6-18(19)3/h4-7,12-14H,8-11,15H2,1-3H3,(H,22,25)