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

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-4-(o-tolylmethyl)piperazine-1-carbothioamide CAS Name: N-(3-chloro-4-methylphenyl)-4-[(2-methylphenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(3-chloro-4-methylphenyl)-4-[(2-methylphenyl)methyl]piperazine-1-carbothioamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-4-(2-methylbenzyl)piperazine-1-carbothioamide Formula: C20H24ClN3S MolecularWeight: 373.94266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=CC=C3C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=CC=C3C)Cl

InChI

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