N'-(1H-benzimidazol-4-ylmethyl)-N'-[(3,5-dimethylpyridin-2-yl)methyl]butane-1,4-diamine

Systemtic Name: N'-(1H-benzimidazol-4-ylmethyl)-N'-[(3,5-dimethylpyridin-2-yl)methyl]butane-1,4-diamine Openeye Name: N'-(1H-benzimidazol-4-ylmethyl)-N'-[(3,5-dimethyl-2-pyridyl)methyl]butane-1,4-diamine CAS Name: N'-(1H-benzimidazol-4-ylmethyl)-N'-[(3,5-dimethyl-2-pyridinyl)methyl]butane-1,4-diamine IUPAC Name: N'-(1H-benzimidazol-4-ylmethyl)-N'-[(3,5-dimethylpyridin-2-yl)methyl]butane-1,4-diamine Traditional Name: 4-aminobutyl-(1H-benzimidazol-4-ylmethyl)-[(3,5-dimethyl-2-pyridyl)methyl]amine Formula: C20H27N5 MolecularWeight: 337.46188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N=C1)CN(CCCCN)CC2=C3C(=CC=C2)NC=N3)C

Isomeric SMILES

CC1=CC(=C(N=C1)CN(CCCCN)CC2=C3C(=CC=C2)NC=N3)C

InChI

InChI=1S/C20H27N5/c1-15-10-16(2)19(22-11-15)13-25(9-4-3-8-21)12-17-6-5-7-18-20(17)24-14-23-18/h5-7,10-11,14H,3-4,8-9,12-13,21H2,1-2H3,(H,23,24)