1-(3-nitrophenyl)-2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(3-nitrophenyl)-2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanone Openeye Name: 1-(3-nitrophenyl)-2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanone CAS Name: 1-(3-nitrophenyl)-2-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]ethanone IUPAC Name: 1-(3-nitrophenyl)-2-(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanone Traditional Name: 1-(3-nitrophenyl)-2-[(5-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=CSC3=C2C(=NC=N3)SCC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SCC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

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