2-(2-methylbutyl)-2-(1-pentyl-4-phenyl-cyclohexa-2,5-dien-1-yl)-1H-pyrimidine

Systemtic Name: 2-(2-methylbutyl)-2-(1-pentyl-4-phenyl-cyclohexa-2,5-dien-1-yl)-1H-pyrimidine Openeye Name: 2-(2-methylbutyl)-2-(1-pentyl-4-phenyl-cyclohexa-2,5-dien-1-yl)-1H-pyrimidine CAS Name: 2-(2-methylbutyl)-2-(1-pentyl-4-phenyl-1-cyclohexa-2,5-dienyl)-1H-pyrimidine IUPAC Name: 2-(2-methylbutyl)-2-(1-pentyl-4-phenylcyclohexa-2,5-dien-1-yl)-1H-pyrimidine Traditional Name: 2-(1-amyl-4-phenyl-cyclohexa-2,5-dien-1-yl)-2-(2-methylbutyl)-1H-pyrimidine Formula: C26H36N2 MolecularWeight: 376.57744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(C=CC(C=C1)C2=CC=CC=C2)C3(NC=CC=N3)CC(C)CC

Isomeric SMILES

CCCCCC1(C=CC(C=C1)C2=CC=CC=C2)C3(NC=CC=N3)CC(C)CC

InChI

InChI=1S/C26H36N2/c1-4-6-10-16-25(26(21-22(3)5-2)27-19-11-20-28-26)17-14-24(15-18-25)23-12-8-7-9-13-23/h7-9,11-15,17-20,22,24,27H,4-6,10,16,21H2,1-3H3