N-[4-[[4-(furan-2-ylmethyl)piperazin-1-yl]methyl]phenyl]-2-methyl-quinoline-8-sulfonamide

Systemtic Name: N-[4-[[4-(furan-2-ylmethyl)piperazin-1-yl]methyl]phenyl]-2-methyl-quinoline-8-sulfonamide Openeye Name: N-[4-[[4-(2-furylmethyl)piperazin-1-yl]methyl]phenyl]-2-methyl-quinoline-8-sulfonamide CAS Name: N-[4-[[4-(2-furanylmethyl)-1-piperazinyl]methyl]phenyl]-2-methyl-8-quinolinesulfonamide IUPAC Name: N-[4-[[4-(furan-2-ylmethyl)piperazin-1-yl]methyl]phenyl]-2-methylquinoline-8-sulfonamide Traditional Name: N-[4-[[4-(2-furfuryl)piperazino]methyl]phenyl]-2-methyl-quinoline-8-sulfonamide Formula: C26H28N4O3S MolecularWeight: 476.59052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2S(=O)(=O)NC3=CC=C(C=C3)CN4CCN(CC4)CC5=CC=CO5)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2S(=O)(=O)NC3=CC=C(C=C3)CN4CCN(CC4)CC5=CC=CO5)C=C1

InChI

InChI=1S/C26H28N4O3S/c1-20-7-10-22-4-2-6-25(26(22)27-20)34(31,32)28-23-11-8-21(9-12-23)18-29-13-15-30(16-14-29)19-24-5-3-17-33-24/h2-12,17,28H,13-16,18-19H2,1H3