5-(4-bromophenyl)-N-(2-chloranyl-4-nitro-phenyl)-6-ethyl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-(4-bromophenyl)-N-(2-chloranyl-4-nitro-phenyl)-6-ethyl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5-(4-bromophenyl)-N-(2-chloro-4-nitro-phenyl)-6-ethyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-(4-bromophenyl)-N-(2-chloro-4-nitrophenyl)-6-ethyl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5-(4-bromophenyl)-N-(2-chloro-4-nitrophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [5-(4-bromophenyl)-6-ethyl-thieno[2,3-d]pyrimidin-4-yl]-(2-chloro-4-nitro-phenyl)amine Formula: C20H14BrClN4O2S MolecularWeight: 489.77276

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N=CN=C2S1)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)C4=CC=C(C=C4)Br

Isomeric SMILES

CCC1=C(C2=C(N=CN=C2S1)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H14BrClN4O2S/c1-2-16-17(11-3-5-12(21)6-4-11)18-19(23-10-24-20(18)29-16)25-15-8-7-13(26(27)28)9-14(15)22/h3-10H,2H2,1H3,(H,23,24,25)