5-[(3-chlorophenyl)methylsulfanylmethyl]-N-[3-(4-methylpiperazin-1-yl)propyl]furan-2-carboxamide

Systemtic Name: 5-[(3-chlorophenyl)methylsulfanylmethyl]-N-[3-(4-methylpiperazin-1-yl)propyl]furan-2-carboxamide Openeye Name: 5-[(3-chlorophenyl)methylsulfanylmethyl]-N-[3-(4-methylpiperazin-1-yl)propyl]furan-2-carboxamide CAS Name: 5-[[(3-chlorophenyl)methylthio]methyl]-N-[3-(4-methyl-1-piperazinyl)propyl]-2-furancarboxamide IUPAC Name: 5-[(3-chlorophenyl)methylsulfanylmethyl]-N-[3-(4-methylpiperazin-1-yl)propyl]furan-2-carboxamide Traditional Name: 5-[[(3-chlorobenzyl)thio]methyl]-N-[3-(4-methylpiperazino)propyl]-2-furamide Formula: C21H28ClN3O2S MolecularWeight: 421.98392

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCNC(=O)C2=CC=C(O2)CSCC3=CC(=CC=C3)Cl

Isomeric SMILES

CN1CCN(CC1)CCCNC(=O)C2=CC=C(O2)CSCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H28ClN3O2S/c1-24-10-12-25(13-11-24)9-3-8-23-21(26)20-7-6-19(27-20)16-28-15-17-4-2-5-18(22)14-17/h2,4-7,14H,3,8-13,15-16H2,1H3,(H,23,26)