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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=S)NC3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=S)NC3=C(C=CC(=C3)Cl)Cl

InChI

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