4-[(2,4-dichlorophenyl)methyl]-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazine-1-carbothioamide

Systemtic Name: 4-[(2,4-dichlorophenyl)methyl]-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazine-1-carbothioamide Openeye Name: 4-[(2,4-dichlorophenyl)methyl]-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazine-1-carbothioamide CAS Name: 4-[(2,4-dichlorophenyl)methyl]-N-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-1-piperazinecarbothioamide IUPAC Name: 4-[(2,4-dichlorophenyl)methyl]-N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]piperazine-1-carbothioamide Traditional Name: 4-(2,4-dichlorobenzyl)-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazine-1-carbothioamide Formula: C19H25Cl2N5S MolecularWeight: 426.4063

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)CNC(=S)N2CCN(CC2)CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCN1C=C(C(=N1)C)CNC(=S)N2CCN(CC2)CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H25Cl2N5S/c1-3-26-13-16(14(2)23-26)11-22-19(27)25-8-6-24(7-9-25)12-15-4-5-17(20)10-18(15)21/h4-5,10,13H,3,6-9,11-12H2,1-2H3,(H,22,27)