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

Systemtic Name: N'-[(3-methylpyridin-2-yl)methyl]-N-[(5-pyridin-2-ylpyridin-2-yl)methyl]butane-1,4-diamine Openeye Name: N'-[(3-methyl-2-pyridyl)methyl]-N-[[5-(2-pyridyl)-2-pyridyl]methyl]butane-1,4-diamine CAS Name: N'-[(3-methyl-2-pyridinyl)methyl]-N-[[5-(2-pyridinyl)-2-pyridinyl]methyl]butane-1,4-diamine IUPAC Name: N'-[(3-methylpyridin-2-yl)methyl]-N-[(5-pyridin-2-ylpyridin-2-yl)methyl]butane-1,4-diamine Traditional Name: (3-methyl-2-pyridyl)methyl-[4-[[5-(2-pyridyl)-2-pyridyl]methylamino]butyl]amine Formula: C22H27N5 MolecularWeight: 361.48328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)CNCCCCNCC2=NC=C(C=C2)C3=CC=CC=N3

Isomeric SMILES

CC1=C(N=CC=C1)CNCCCCNCC2=NC=C(C=C2)C3=CC=CC=N3

InChI

InChI=1S/C22H27N5/c1-18-7-6-14-26-22(18)17-24-12-5-4-11-23-16-20-10-9-19(15-27-20)21-8-2-3-13-25-21/h2-3,6-10,13-15,23-24H,4-5,11-12,16-17H2,1H3