4-chloranyl-6-hexyl-5-pentyl-2-phenyl-pyrimidine

Systemtic Name: 4-chloranyl-6-hexyl-5-pentyl-2-phenyl-pyrimidine Openeye Name: 4-chloro-6-hexyl-5-pentyl-2-phenyl-pyrimidine CAS Name: 4-chloro-6-hexyl-5-pentyl-2-phenylpyrimidine IUPAC Name: 4-chloro-6-hexyl-5-pentyl-2-phenylpyrimidine Traditional Name: 5-amyl-4-chloro-6-hexyl-2-phenyl-pyrimidine Formula: C21H29ClN2 MolecularWeight: 344.92136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=NC(=N1)C2=CC=CC=C2)Cl)CCCCC

Isomeric SMILES

CCCCCCC1=C(C(=NC(=N1)C2=CC=CC=C2)Cl)CCCCC

InChI

InChI=1S/C21H29ClN2/c1-3-5-7-12-16-19-18(15-9-6-4-2)20(22)24-21(23-19)17-13-10-8-11-14-17/h8,10-11,13-14H,3-7,9,12,15-16H2,1-2H3