N'-[(3,5-dimethylpyridin-2-yl)methyl]-N'-[[3-(phenylsulfinyl)pyridin-2-yl]methyl]butane-1,4-diamine

Systemtic Name: N'-[(3,5-dimethylpyridin-2-yl)methyl]-N'-[[3-(phenylsulfinyl)pyridin-2-yl]methyl]butane-1,4-diamine Openeye Name: N'-[[3-(benzenesulfinyl)-2-pyridyl]methyl]-N'-[(3,5-dimethyl-2-pyridyl)methyl]butane-1,4-diamine CAS Name: N'-[[3-(benzenesulfinyl)-2-pyridinyl]methyl]-N'-[(3,5-dimethyl-2-pyridinyl)methyl]butane-1,4-diamine IUPAC Name: N'-[[3-(benzenesulfinyl)pyridin-2-yl]methyl]-N'-[(3,5-dimethylpyridin-2-yl)methyl]butane-1,4-diamine Traditional Name: 4-aminobutyl-[[3-(benzenesulfinyl)-2-pyridyl]methyl]-[(3,5-dimethyl-2-pyridyl)methyl]amine Formula: C24H30N4OS MolecularWeight: 422.5862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N=C1)CN(CCCCN)CC2=C(C=CC=N2)S(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(N=C1)CN(CCCCN)CC2=C(C=CC=N2)S(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C24H30N4OS/c1-19-15-20(2)22(27-16-19)17-28(14-7-6-12-25)18-23-24(11-8-13-26-23)30(29)21-9-4-3-5-10-21/h3-5,8-11,13,15-16H,6-7,12,14,17-18,25H2,1-2H3