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

Systemtic Name: N-(3,4-diethoxyphenyl)-5-(4-fluorophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(3,4-diethoxyphenyl)-5-(4-fluorophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(3,4-diethoxyphenyl)-5-(4-fluorophenyl)-6-methyl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(3,4-diethoxyphenyl)-5-(4-fluorophenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (3,4-diethoxyphenyl)-[5-(4-fluorophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amine Formula: C23H22FN3O2S MolecularWeight: 423.503083

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC2=C3C(=C(SC3=NC=N2)C)C4=CC=C(C=C4)F)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC2=C3C(=C(SC3=NC=N2)C)C4=CC=C(C=C4)F)OCC

InChI

InChI=1S/C23H22FN3O2S/c1-4-28-18-11-10-17(12-19(18)29-5-2)27-22-21-20(15-6-8-16(24)9-7-15)14(3)30-23(21)26-13-25-22/h6-13H,4-5H2,1-3H3,(H,25,26,27)