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

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-4-(3,4-dichlorophenyl)piperazine-1-carbothioamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-4-(3,4-dichlorophenyl)piperazine-1-carbothioamide CAS Name: N-(3-chloro-4-methylphenyl)-4-(3,4-dichlorophenyl)-1-piperazinecarbothioamide IUPAC Name: N-(3-chloro-4-methylphenyl)-4-(3,4-dichlorophenyl)piperazine-1-carbothioamide Traditional Name: N-(3-chloro-4-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=C(C=C1)NC(=S)N2CCN(CC2)C3=CC(=C(C=C3)Cl)Cl)Cl

Isomeric SMILES

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

InChI

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