N2-(2-bromanyl-4-propan-2-yl-phenyl)-N4-butyl-N4-ethyl-6-methyl-pyridine-2,3,4-triamine

Systemtic Name: N2-(2-bromanyl-4-propan-2-yl-phenyl)-N4-butyl-N4-ethyl-6-methyl-pyridine-2,3,4-triamine Openeye Name: N2-(2-bromo-4-isopropyl-phenyl)-N4-butyl-N4-ethyl-6-methyl-pyridine-2,3,4-triamine CAS Name: N2-(2-bromo-4-propan-2-ylphenyl)-N4-butyl-N4-ethyl-6-methylpyridine-2,3,4-triamine IUPAC Name: 2-N-(2-bromo-4-propan-2-ylphenyl)-4-N-butyl-4-N-ethyl-6-methylpyridine-2,3,4-triamine Traditional Name: [3-amino-2-(2-bromo-4-isopropyl-anilino)-6-methyl-4-pyridyl]-butyl-ethyl-amine Formula: C21H31BrN4 MolecularWeight: 419.40164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C1=CC(=NC(=C1N)NC2=C(C=C(C=C2)C(C)C)Br)C

Isomeric SMILES

CCCCN(CC)C1=CC(=NC(=C1N)NC2=C(C=C(C=C2)C(C)C)Br)C

InChI

InChI=1S/C21H31BrN4/c1-6-8-11-26(7-2)19-12-15(5)24-21(20(19)23)25-18-10-9-16(14(3)4)13-17(18)22/h9-10,12-14H,6-8,11,23H2,1-5H3,(H,24,25)