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

Systemtic Name: 5-(4-bromophenyl)-N-(3,4-diethoxyphenyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5-(4-bromophenyl)-N-(3,4-diethoxyphenyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-(4-bromophenyl)-N-(3,4-diethoxyphenyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5-(4-bromophenyl)-N-(3,4-diethoxyphenyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: [5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]-(3,4-diethoxyphenyl)amine Formula: C22H20BrN3O2S MolecularWeight: 470.3821

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)Br)OCC

InChI

InChI=1S/C22H20BrN3O2S/c1-3-27-18-10-9-16(11-19(18)28-4-2)26-21-20-17(12-29-22(20)25-13-24-21)14-5-7-15(23)8-6-14/h5-13H,3-4H2,1-2H3,(H,24,25,26)