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

Systemtic Name: 4-[(3-chlorophenyl)methyl]-N-(2,5-dimethylphenyl)piperazine-1-carbothioamide Openeye Name: 4-[(3-chlorophenyl)methyl]-N-(2,5-dimethylphenyl)piperazine-1-carbothioamide CAS Name: 4-[(3-chlorophenyl)methyl]-N-(2,5-dimethylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[(3-chlorophenyl)methyl]-N-(2,5-dimethylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(3-chlorobenzyl)-N-(2,5-dimethylphenyl)piperazine-1-carbothioamide Formula: C20H24ClN3S MolecularWeight: 373.94266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)N2CCN(CC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)N2CCN(CC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H24ClN3S/c1-15-6-7-16(2)19(12-15)22-20(25)24-10-8-23(9-11-24)14-17-4-3-5-18(21)13-17/h3-7,12-13H,8-11,14H2,1-2H3,(H,22,25)