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

Systemtic Name: 5-(2-methylbutyl)-2-(1-pentyl-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine Openeye Name: 5-(2-methylbutyl)-2-(1-pentyl-4-phenyl-cyclohexa-2,5-dien-1-yl)pyrimidine CAS Name: 5-(2-methylbutyl)-2-(1-pentyl-4-phenyl-1-cyclohexa-2,5-dienyl)pyrimidine IUPAC Name: 5-(2-methylbutyl)-2-(1-pentyl-4-phenylcyclohexa-2,5-dien-1-yl)pyrimidine Traditional Name: 2-(1-amyl-4-phenyl-cyclohexa-2,5-dien-1-yl)-5-(2-methylbutyl)pyrimidine Formula: C26H34N2 MolecularWeight: 374.56156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34N2/c1-4-6-10-15-26(25-27-19-22(20-28-25)18-21(3)5-2)16-13-24(14-17-26)23-11-8-7-9-12-23/h7-9,11-14,16-17,19-21,24H,4-6,10,15,18H2,1-3H3