1-(4-nitrophenyl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(4-nitrophenyl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanone Openeye Name: 1-(4-nitrophenyl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanone CAS Name: 1-(4-nitrophenyl)-2-[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]ethanone IUPAC Name: 1-(4-nitrophenyl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanone Traditional Name: 1-(4-nitrophenyl)-2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)thio]ethanone Formula: C20H13N3O3S2 MolecularWeight: 407.46552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(S2)N=CN=C3SCC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(S2)N=CN=C3SCC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H13N3O3S2/c24-17(13-6-8-15(9-7-13)23(25)26)11-27-19-16-10-18(14-4-2-1-3-5-14)28-20(16)22-12-21-19/h1-10,12H,11H2