7-(4-azanyl-3-nitro-phenyl)-N-(4-morpholin-4-ylphenyl)thieno[3,2-d]pyrimidin-2-amine

Systemtic Name: 7-(4-azanyl-3-nitro-phenyl)-N-(4-morpholin-4-ylphenyl)thieno[3,2-d]pyrimidin-2-amine Openeye Name: 7-(4-amino-3-nitro-phenyl)-N-(4-morpholinophenyl)thieno[3,2-d]pyrimidin-2-amine CAS Name: 7-(4-amino-3-nitrophenyl)-N-[4-(4-morpholinyl)phenyl]-2-thieno[3,2-d]pyrimidinamine IUPAC Name: 7-(4-amino-3-nitrophenyl)-N-(4-morpholin-4-ylphenyl)thieno[3,2-d]pyrimidin-2-amine Traditional Name: [7-(4-amino-3-nitro-phenyl)thieno[3,2-d]pyrimidin-2-yl]-(4-morpholinophenyl)amine Formula: C22H20N6O3S MolecularWeight: 448.4976

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC3=NC=C4C(=N3)C(=CS4)C5=CC(=C(C=C5)N)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC3=NC=C4C(=N3)C(=CS4)C5=CC(=C(C=C5)N)[N+](=O)[O-]

InChI

InChI=1S/C22H20N6O3S/c23-18-6-1-14(11-19(18)28(29)30)17-13-32-20-12-24-22(26-21(17)20)25-15-2-4-16(5-3-15)27-7-9-31-10-8-27/h1-6,11-13H,7-10,23H2,(H,24,25,26)