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

Systemtic Name: 5-[(4-methylphenyl)sulfonylmethyl]-N-[3-(4-methylpiperazin-1-yl)propyl]furan-2-carboxamide Openeye Name: N-[3-(4-methylpiperazin-1-yl)propyl]-5-(p-tolylsulfonylmethyl)furan-2-carboxamide CAS Name: 5-[(4-methylphenyl)sulfonylmethyl]-N-[3-(4-methyl-1-piperazinyl)propyl]-2-furancarboxamide IUPAC Name: 5-[(4-methylphenyl)sulfonylmethyl]-N-[3-(4-methylpiperazin-1-yl)propyl]furan-2-carboxamide Traditional Name: N-[3-(4-methylpiperazino)propyl]-5-(tosylmethyl)-2-furamide Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(O2)C(=O)NCCCN3CCN(CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(O2)C(=O)NCCCN3CCN(CC3)C

InChI

InChI=1S/C21H29N3O4S/c1-17-4-7-19(8-5-17)29(26,27)16-18-6-9-20(28-18)21(25)22-10-3-11-24-14-12-23(2)13-15-24/h4-9H,3,10-16H2,1-2H3,(H,22,25)