N-(2-chloranyl-3-methyl-phenyl)-4-(3,4-dichlorophenyl)piperazine-1-carbothioamide

Systemtic Name: N-(2-chloranyl-3-methyl-phenyl)-4-(3,4-dichlorophenyl)piperazine-1-carbothioamide Openeye Name: N-(2-chloro-3-methyl-phenyl)-4-(3,4-dichlorophenyl)piperazine-1-carbothioamide CAS Name: N-(2-chloro-3-methylphenyl)-4-(3,4-dichlorophenyl)-1-piperazinecarbothioamide IUPAC Name: N-(2-chloro-3-methylphenyl)-4-(3,4-dichlorophenyl)piperazine-1-carbothioamide Traditional Name: N-(2-chloro-3-methyl-phenyl)-4-(3,4-dichlorophenyl)piperazine-1-carbothioamide Formula: C18H18Cl3N3S MolecularWeight: 414.77962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)N2CCN(CC2)C3=CC(=C(C=C3)Cl)Cl)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)N2CCN(CC2)C3=CC(=C(C=C3)Cl)Cl)Cl

InChI

InChI=1S/C18H18Cl3N3S/c1-12-3-2-4-16(17(12)21)22-18(25)24-9-7-23(8-10-24)13-5-6-14(19)15(20)11-13/h2-6,11H,7-10H2,1H3,(H,22,25)