2-[4-(5-heptylpyrimidin-2-yl)phenyl]-5-hexyl-1,3,4-thiadiazole

Systemtic Name: 2-[4-(5-heptylpyrimidin-2-yl)phenyl]-5-hexyl-1,3,4-thiadiazole Openeye Name: 2-[4-(5-heptylpyrimidin-2-yl)phenyl]-5-hexyl-1,3,4-thiadiazole CAS Name: 2-[4-(5-heptyl-2-pyrimidinyl)phenyl]-5-hexyl-1,3,4-thiadiazole IUPAC Name: 2-[4-(5-heptylpyrimidin-2-yl)phenyl]-5-hexyl-1,3,4-thiadiazole Traditional Name: 2-[4-(5-heptylpyrimidin-2-yl)phenyl]-5-hexyl-1,3,4-thiadiazole Formula: C25H34N4S MolecularWeight: 422.62926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=NN=C(S3)CCCCCC

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=NN=C(S3)CCCCCC

InChI

InChI=1S/C25H34N4S/c1-3-5-7-9-10-12-20-18-26-24(27-19-20)21-14-16-22(17-15-21)25-29-28-23(30-25)13-11-8-6-4-2/h14-19H,3-13H2,1-2H3