5-(4-ethoxyphenyl)-N-(4-hexoxyphenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-(4-ethoxyphenyl)-N-(4-hexoxyphenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5-(4-ethoxyphenyl)-N-(4-hexoxyphenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-(4-ethoxyphenyl)-N-(4-hexoxyphenyl)-6-methyl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5-(4-ethoxyphenyl)-N-(4-hexoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (4-hexoxyphenyl)-(6-methyl-5-p-phenetyl-thieno[2,3-d]pyrimidin-4-yl)amine Formula: C27H31N3O2S MolecularWeight: 461.61894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)NC2=C3C(=C(SC3=NC=N2)C)C4=CC=C(C=C4)OCC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)NC2=C3C(=C(SC3=NC=N2)C)C4=CC=C(C=C4)OCC

InChI

InChI=1S/C27H31N3O2S/c1-4-6-7-8-17-32-23-15-11-21(12-16-23)30-26-25-24(19(3)33-27(25)29-18-28-26)20-9-13-22(14-10-20)31-5-2/h9-16,18H,4-8,17H2,1-3H3,(H,28,29,30)