5-heptyl-2-[4-[(4S)-4-methylhexoxy]phenyl]pyrimidine

Systemtic Name: 5-heptyl-2-[4-[(4S)-4-methylhexoxy]phenyl]pyrimidine Openeye Name: 5-heptyl-2-[4-[(4S)-4-methylhexoxy]phenyl]pyrimidine CAS Name: 5-heptyl-2-[4-[(4S)-4-methylhexoxy]phenyl]pyrimidine IUPAC Name: 5-heptyl-2-[4-[(4S)-4-methylhexoxy]phenyl]pyrimidine Traditional Name: 5-heptyl-2-[4-[(4S)-4-methylhexoxy]phenyl]pyrimidine Formula: C24H36N2O MolecularWeight: 368.55544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCC(C)CC

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC[C@@H](C)CC

InChI

InChI=1S/C24H36N2O/c1-4-6-7-8-9-12-21-18-25-24(26-19-21)22-13-15-23(16-14-22)27-17-10-11-20(3)5-2/h13-16,18-20H,4-12,17H2,1-3H3/t20-/m0/s1