5-(4-bromophenyl)-N-(2,5-diethoxy-4-morpholin-4-yl-phenyl)thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-(4-bromophenyl)-N-(2,5-diethoxy-4-morpholin-4-yl-phenyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5-(4-bromophenyl)-N-(2,5-diethoxy-4-morpholino-phenyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-(4-bromophenyl)-N-[2,5-diethoxy-4-(4-morpholinyl)phenyl]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5-(4-bromophenyl)-N-(2,5-diethoxy-4-morpholin-4-ylphenyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: [5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]-(2,5-diethoxy-4-morpholino-phenyl)amine Formula: C26H27BrN4O3S MolecularWeight: 555.48658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1N2CCOCC2)OCC)NC3=C4C(=CSC4=NC=N3)C5=CC=C(C=C5)Br

Isomeric SMILES

CCOC1=CC(=C(C=C1N2CCOCC2)OCC)NC3=C4C(=CSC4=NC=N3)C5=CC=C(C=C5)Br

InChI

InChI=1S/C26H27BrN4O3S/c1-3-33-22-14-21(31-9-11-32-12-10-31)23(34-4-2)13-20(22)30-25-24-19(15-35-26(24)29-16-28-25)17-5-7-18(27)8-6-17/h5-8,13-16H,3-4,9-12H2,1-2H3,(H,28,29,30)