4-[(4-cyanophenyl)methyl]-N-(3-methylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[(4-cyanophenyl)methyl]-N-(3-methylphenyl)piperazine-1-carbothioamide Openeye Name: 4-[(4-cyanophenyl)methyl]-N-(m-tolyl)piperazine-1-carbothioamide CAS Name: 4-[(4-cyanophenyl)methyl]-N-(3-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[(4-cyanophenyl)methyl]-N-(3-methylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(4-cyanobenzyl)-N-(m-tolyl)piperazine-1-carbothioamide Formula: C20H22N4S MolecularWeight: 350.48048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4S/c1-16-3-2-4-19(13-16)22-20(25)24-11-9-23(10-12-24)15-18-7-5-17(14-21)6-8-18/h2-8,13H,9-12,15H2,1H3,(H,22,25)