N-(furan-2-ylmethyl)-4-(phenylmethyl)piperazine-1-carbothioamide

Systemtic Name: N-(furan-2-ylmethyl)-4-(phenylmethyl)piperazine-1-carbothioamide Openeye Name: 4-benzyl-N-(2-furylmethyl)piperazine-1-carbothioamide CAS Name: N-(2-furanylmethyl)-4-(phenylmethyl)-1-piperazinecarbothioamide IUPAC Name: 4-benzyl-N-(furan-2-ylmethyl)piperazine-1-carbothioamide Traditional Name: 4-benzyl-N-(2-furfuryl)piperazine-1-carbothioamide Formula: C17H21N3OS MolecularWeight: 315.43314

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=S)NCC3=CC=CO3

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=S)NCC3=CC=CO3

InChI

InChI=1S/C17H21N3OS/c22-17(18-13-16-7-4-12-21-16)20-10-8-19(9-11-20)14-15-5-2-1-3-6-15/h1-7,12H,8-11,13-14H2,(H,18,22)