5-[(E)-2-chloranylethenyl]-2-cyclohexyl-4-(3-propylphenyl)pyrimidine

Systemtic Name: 5-[(E)-2-chloranylethenyl]-2-cyclohexyl-4-(3-propylphenyl)pyrimidine Openeye Name: 5-[(E)-2-chlorovinyl]-2-cyclohexyl-4-(3-propylphenyl)pyrimidine CAS Name: 5-[(E)-2-chloroethenyl]-2-cyclohexyl-4-(3-propylphenyl)pyrimidine IUPAC Name: 5-[(E)-2-chloroethenyl]-2-cyclohexyl-4-(3-propylphenyl)pyrimidine Traditional Name: 5-[(E)-2-chlorovinyl]-2-cyclohexyl-4-(3-propylphenyl)pyrimidine Formula: C21H25ClN2 MolecularWeight: 340.8896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC(=C1)C2=NC(=NC=C2C=CCl)C3CCCCC3

Isomeric SMILES

CCCC1=CC=CC(=C1)C2=NC(=NC=C2/C=C/Cl)C3CCCCC3

InChI

InChI=1S/C21H25ClN2/c1-2-7-16-8-6-11-18(14-16)20-19(12-13-22)15-23-21(24-20)17-9-4-3-5-10-17/h6,8,11-15,17H,2-5,7,9-10H2,1H3/b13-12+