(3E)-N-(3-butylpyridin-2-yl)-3-(3-butylpyridin-2-yl)imino-isoindol-1-amine

Systemtic Name: (3E)-N-(3-butylpyridin-2-yl)-3-(3-butylpyridin-2-yl)imino-isoindol-1-amine Openeye Name: (3E)-N-(3-butyl-2-pyridyl)-3-[(3-butyl-2-pyridyl)imino]isoindol-1-amine CAS Name: (3E)-N-(3-butyl-2-pyridinyl)-3-[(3-butyl-2-pyridinyl)imino]-1-isoindolamine IUPAC Name: (3E)-N-(3-butylpyridin-2-yl)-3-(3-butylpyridin-2-yl)iminoisoindol-1-amine Traditional Name: (3-butyl-2-pyridyl)-[(3E)-3-[(3-butyl-2-pyridyl)imino]isoindol-1-yl]amine Formula: C26H29N5 MolecularWeight: 411.54196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N=CC=C1)NC2=NC(=NC3=C(C=CC=N3)CCCC)C4=CC=CC=C42

Isomeric SMILES

CCCCC1=C(N=CC=C1)NC2=N/C(=N/C3=C(C=CC=N3)CCCC)/C4=CC=CC=C42

InChI

InChI=1S/C26H29N5/c1-3-5-11-19-13-9-17-27-23(19)29-25-21-15-7-8-16-22(21)26(31-25)30-24-20(12-6-4-2)14-10-18-28-24/h7-10,13-18H,3-6,11-12H2,1-2H3,(H,27,28,29,30,31)