N,N-bis[[6-(hydroxymethyl)pyridin-2-yl]methyl]-4-methyl-benzenesulfonamide

Systemtic Name: N,N-bis[[6-(hydroxymethyl)pyridin-2-yl]methyl]-4-methyl-benzenesulfonamide Openeye Name: N,N-bis[[6-(hydroxymethyl)-2-pyridyl]methyl]-4-methyl-benzenesulfonamide CAS Name: N,N-bis[[6-(hydroxymethyl)-2-pyridinyl]methyl]-4-methylbenzenesulfonamide IUPAC Name: N,N-bis[[6-(hydroxymethyl)pyridin-2-yl]methyl]-4-methylbenzenesulfonamide Traditional Name: 4-methyl-N,N-bis[(6-methylol-2-pyridyl)methyl]benzenesulfonamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=NC(=CC=C2)CO)CC3=NC(=CC=C3)CO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=NC(=CC=C2)CO)CC3=NC(=CC=C3)CO

InChI

InChI=1S/C21H23N3O4S/c1-16-8-10-21(11-9-16)29(27,28)24(12-17-4-2-6-19(14-25)22-17)13-18-5-3-7-20(15-26)23-18/h2-11,25-26H,12-15H2,1H3