5-[(1-methylimidazol-2-yl)sulfanylmethyl]-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]furan-2-carboxamide

Systemtic Name: 5-[(1-methylimidazol-2-yl)sulfanylmethyl]-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]furan-2-carboxamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-5-[(1-methylimidazol-2-yl)sulfanylmethyl]furan-2-carboxamide CAS Name: 5-[[(1-methyl-2-imidazolyl)thio]methyl]-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-2-furancarboxamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-5-[(1-methylimidazol-2-yl)sulfanylmethyl]furan-2-carboxamide Traditional Name: N-[3-(4-benzylpiperazino)propyl]-5-[[(1-methylimidazol-2-yl)thio]methyl]-2-furamide Formula: C24H31N5O2S MolecularWeight: 453.60024

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC2=CC=C(O2)C(=O)NCCCN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CN1C=CN=C1SCC2=CC=C(O2)C(=O)NCCCN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H31N5O2S/c1-27-13-11-26-24(27)32-19-21-8-9-22(31-21)23(30)25-10-5-12-28-14-16-29(17-15-28)18-20-6-3-2-4-7-20/h2-4,6-9,11,13H,5,10,12,14-19H2,1H3,(H,25,30)