[5-(4-bromophenyl)furan-2-yl]-[4-(phenylmethyl)piperazin-1-yl]methanethione

Systemtic Name: [5-(4-bromophenyl)furan-2-yl]-[4-(phenylmethyl)piperazin-1-yl]methanethione Openeye Name: (4-benzylpiperazin-1-yl)-[5-(4-bromophenyl)-2-furyl]methanethione CAS Name: [5-(4-bromophenyl)-2-furanyl]-[4-(phenylmethyl)-1-piperazinyl]methanethione IUPAC Name: (4-benzylpiperazin-1-yl)-[5-(4-bromophenyl)furan-2-yl]methanethione Traditional Name: (4-benzylpiperazino)-[5-(4-bromophenyl)-2-furyl]methanethione Formula: C22H21BrN2OS MolecularWeight: 441.38394

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=S)C3=CC=C(O3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=S)C3=CC=C(O3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H21BrN2OS/c23-19-8-6-18(7-9-19)20-10-11-21(26-20)22(27)25-14-12-24(13-15-25)16-17-4-2-1-3-5-17/h1-11H,12-16H2