N-[3,5-bis(chloranyl)phenyl]-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-[3,5-bis(chloranyl)phenyl]-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-(3,5-dichlorophenyl)-4-(o-tolylmethyl)piperazine-1-carbothioamide CAS Name: N-(3,5-dichlorophenyl)-4-[(2-methylphenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(3,5-dichlorophenyl)-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide Traditional Name: N-(3,5-dichlorophenyl)-4-(2-methylbenzyl)piperazine-1-carbothioamide Formula: C19H21Cl2N3S MolecularWeight: 394.36114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=S)NC3=CC(=CC(=C3)Cl)Cl

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=S)NC3=CC(=CC(=C3)Cl)Cl

InChI

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