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

Systemtic Name: 4-[(2,4-dichlorophenyl)methyl]-N-(2-methylphenyl)piperazine-1-carbothioamide Openeye Name: 4-[(2,4-dichlorophenyl)methyl]-N-(o-tolyl)piperazine-1-carbothioamide CAS Name: 4-[(2,4-dichlorophenyl)methyl]-N-(2-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[(2,4-dichlorophenyl)methyl]-N-(2-methylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(2,4-dichlorobenzyl)-N-(o-tolyl)piperazine-1-carbothioamide Formula: C19H21Cl2N3S MolecularWeight: 394.36114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)N2CCN(CC2)CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N2CCN(CC2)CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H21Cl2N3S/c1-14-4-2-3-5-18(14)22-19(25)24-10-8-23(9-11-24)13-15-6-7-16(20)12-17(15)21/h2-7,12H,8-11,13H2,1H3,(H,22,25)