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

Systemtic Name: 4-(1,2-benzothiazol-3-yl)-N-(furan-2-ylmethyl)piperazine-1-carbothioamide Openeye Name: 4-(1,2-benzothiazol-3-yl)-N-(2-furylmethyl)piperazine-1-carbothioamide CAS Name: 4-(1,2-benzothiazol-3-yl)-N-(2-furanylmethyl)-1-piperazinecarbothioamide IUPAC Name: 4-(1,2-benzothiazol-3-yl)-N-(furan-2-ylmethyl)piperazine-1-carbothioamide Traditional Name: 4-(1,2-benzothiazol-3-yl)-N-(2-furfuryl)piperazine-1-carbothioamide Formula: C17H18N4OS2 MolecularWeight: 358.48102

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NSC3=CC=CC=C32)C(=S)NCC4=CC=CO4

Isomeric SMILES

C1CN(CCN1C2=NSC3=CC=CC=C32)C(=S)NCC4=CC=CO4

InChI

InChI=1S/C17H18N4OS2/c23-17(18-12-13-4-3-11-22-13)21-9-7-20(8-10-21)16-14-5-1-2-6-15(14)24-19-16/h1-6,11H,7-10,12H2,(H,18,23)