N-[(2,4-dichlorophenyl)methyl]-4-(furan-2-ylcarbonyl)piperazine-1-carbothioamide

Systemtic Name: N-[(2,4-dichlorophenyl)methyl]-4-(furan-2-ylcarbonyl)piperazine-1-carbothioamide Openeye Name: N-[(2,4-dichlorophenyl)methyl]-4-(furan-2-carbonyl)piperazine-1-carbothioamide CAS Name: N-[(2,4-dichlorophenyl)methyl]-4-[2-furanyl(oxo)methyl]-1-piperazinecarbothioamide IUPAC Name: N-[(2,4-dichlorophenyl)methyl]-4-(furan-2-carbonyl)piperazine-1-carbothioamide Traditional Name: N-(2,4-dichlorobenzyl)-4-(2-furoyl)piperazine-1-carbothioamide Formula: C17H17Cl2N3O2S MolecularWeight: 398.30678

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CO2)C(=S)NCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CO2)C(=S)NCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H17Cl2N3O2S/c18-13-4-3-12(14(19)10-13)11-20-17(25)22-7-5-21(6-8-22)16(23)15-2-1-9-24-15/h1-4,9-10H,5-8,11H2,(H,20,25)