N-[2-(4-dodecoxyphenyl)ethyl]-5-methyl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-[2-(4-dodecoxyphenyl)ethyl]-5-methyl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[2-(4-dodecoxyphenyl)ethyl]-5-methyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[2-(4-dodecoxyphenyl)ethyl]-5-methyl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[2-(4-dodecoxyphenyl)ethyl]-5-methylthieno[2,3-d]pyrimidin-4-amine Traditional Name: 2-(4-lauryloxyphenyl)ethyl-(5-methylthieno[2,3-d]pyrimidin-4-yl)amine Formula: C27H39N3OS MolecularWeight: 453.68306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)CCNC2=C3C(=CSC3=NC=N2)C

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)CCNC2=C3C(=CSC3=NC=N2)C

InChI

InChI=1S/C27H39N3OS/c1-3-4-5-6-7-8-9-10-11-12-19-31-24-15-13-23(14-16-24)17-18-28-26-25-22(2)20-32-27(25)30-21-29-26/h13-16,20-21H,3-12,17-19H2,1-2H3,(H,28,29,30)