5-heptyl-2-(5-undecoxythieno[3,2-b]thiophen-2-yl)pyrimidine

Systemtic Name: 5-heptyl-2-(5-undecoxythieno[3,2-b]thiophen-2-yl)pyrimidine Openeye Name: 5-heptyl-2-(5-undecoxythieno[3,2-b]thiophen-2-yl)pyrimidine CAS Name: 5-heptyl-2-(5-undecoxy-2-thieno[3,2-b]thiophenyl)pyrimidine IUPAC Name: 5-heptyl-2-(5-undecoxythieno[3,2-b]thiophen-2-yl)pyrimidine Traditional Name: 5-heptyl-2-(5-undecoxythieno[3,2-b]thiophen-2-yl)pyrimidine Formula: C28H42N2OS2 MolecularWeight: 486.77588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC1=CC2=C(S1)C=C(S2)C3=NC=C(C=N3)CCCCCCC

Isomeric SMILES

CCCCCCCCCCCOC1=CC2=C(S1)C=C(S2)C3=NC=C(C=N3)CCCCCCC

InChI

InChI=1S/C28H42N2OS2/c1-3-5-7-9-10-11-12-14-16-18-31-27-20-25-24(33-27)19-26(32-25)28-29-21-23(22-30-28)17-15-13-8-6-4-2/h19-22H,3-18H2,1-2H3