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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=S)NC3=CC=CC(=C3C)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=S)NC3=CC=CC(=C3C)C

InChI

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