N-butan-2-yl-4-[(2,4-dichlorophenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-butan-2-yl-4-[(2,4-dichlorophenyl)methyl]piperazine-1-carbothioamide Openeye Name: 4-[(2,4-dichlorophenyl)methyl]-N-sec-butyl-piperazine-1-carbothioamide CAS Name: N-butan-2-yl-4-[(2,4-dichlorophenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-butan-2-yl-4-[(2,4-dichlorophenyl)methyl]piperazine-1-carbothioamide Traditional Name: 4-(2,4-dichlorobenzyl)-N-sec-butyl-piperazine-1-carbothioamide Formula: C16H23Cl2N3S MolecularWeight: 360.34492

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=S)N1CCN(CC1)CC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCC(C)NC(=S)N1CCN(CC1)CC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H23Cl2N3S/c1-3-12(2)19-16(22)21-8-6-20(7-9-21)11-13-4-5-14(17)10-15(13)18/h4-5,10,12H,3,6-9,11H2,1-2H3,(H,19,22)