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

Systemtic Name: N-[(3,4-dichlorophenyl)methyl]-4-pyridin-2-yl-piperazine-1-carbothioamide Openeye Name: N-[(3,4-dichlorophenyl)methyl]-4-(2-pyridyl)piperazine-1-carbothioamide CAS Name: N-[(3,4-dichlorophenyl)methyl]-4-(2-pyridinyl)-1-piperazinecarbothioamide IUPAC Name: N-[(3,4-dichlorophenyl)methyl]-4-pyridin-2-ylpiperazine-1-carbothioamide Traditional Name: N-(3,4-dichlorobenzyl)-4-(2-pyridyl)piperazine-1-carbothioamide Formula: C17H18Cl2N4S MolecularWeight: 381.32262

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=S)NCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=S)NCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H18Cl2N4S/c18-14-5-4-13(11-15(14)19)12-21-17(24)23-9-7-22(8-10-23)16-3-1-2-6-20-16/h1-6,11H,7-10,12H2,(H,21,24)