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

Systemtic Name: N-[2,5-bis(chloranyl)phenyl]-4-methyl-piperazine-1-carbothioamide Openeye Name: N-(2,5-dichlorophenyl)-4-methyl-piperazine-1-carbothioamide CAS Name: N-(2,5-dichlorophenyl)-4-methyl-1-piperazinecarbothioamide IUPAC Name: N-(2,5-dichlorophenyl)-4-methylpiperazine-1-carbothioamide Traditional Name: N-(2,5-dichlorophenyl)-4-methyl-piperazine-1-carbothioamide Formula: C12H15Cl2N3S MolecularWeight: 304.2386

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=S)NC2=C(C=CC(=C2)Cl)Cl

Isomeric SMILES

CN1CCN(CC1)C(=S)NC2=C(C=CC(=C2)Cl)Cl

InChI

InChI=1S/C12H15Cl2N3S/c1-16-4-6-17(7-5-16)12(18)15-11-8-9(13)2-3-10(11)14/h2-3,8H,4-7H2,1H3,(H,15,18)