4-(3,4-dichlorophenyl)-N-(furan-2-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: 4-(3,4-dichlorophenyl)-N-(furan-2-ylmethyl)piperazine-1-carbothioamide Openeye Name: 4-(3,4-dichlorophenyl)-N-(2-furylmethyl)piperazine-1-carbothioamide CAS Name: 4-(3,4-dichlorophenyl)-N-(2-furanylmethyl)-1-piperazinecarbothioamide IUPAC Name: 4-(3,4-dichlorophenyl)-N-(furan-2-ylmethyl)piperazine-1-carbothioamide Traditional Name: 4-(3,4-dichlorophenyl)-N-(2-furfuryl)piperazine-1-carbothioamide Formula: C16H17Cl2N3OS MolecularWeight: 370.29668

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)Cl)Cl)C(=S)NCC3=CC=CO3

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)Cl)Cl)C(=S)NCC3=CC=CO3

InChI

InChI=1S/C16H17Cl2N3OS/c17-14-4-3-12(10-15(14)18)20-5-7-21(8-6-20)16(23)19-11-13-2-1-9-22-13/h1-4,9-10H,5-8,11H2,(H,19,23)