4-[(3-methylphenyl)methyl]-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]piperazine-1-carbothioamide

Systemtic Name: 4-[(3-methylphenyl)methyl]-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]piperazine-1-carbothioamide Openeye Name: 4-(m-tolylmethyl)-N-[1-(o-tolylmethyl)pyrazol-4-yl]piperazine-1-carbothioamide CAS Name: 4-[(3-methylphenyl)methyl]-N-[1-[(2-methylphenyl)methyl]-4-pyrazolyl]-1-piperazinecarbothioamide IUPAC Name: 4-[(3-methylphenyl)methyl]-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]piperazine-1-carbothioamide Traditional Name: 4-(3-methylbenzyl)-N-[1-(2-methylbenzyl)pyrazol-4-yl]piperazine-1-carbothioamide Formula: C24H29N5S MolecularWeight: 419.58556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=S)NC3=CN(N=C3)CC4=CC=CC=C4C

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=S)NC3=CN(N=C3)CC4=CC=CC=C4C

InChI

InChI=1S/C24H29N5S/c1-19-6-5-8-21(14-19)16-27-10-12-28(13-11-27)24(30)26-23-15-25-29(18-23)17-22-9-4-3-7-20(22)2/h3-9,14-15,18H,10-13,16-17H2,1-2H3,(H,26,30)