2-[[3-(4-nitrophenyl)-4-oxidanylidene-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[3-(4-nitrophenyl)-4-oxidanylidene-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]ethanamide Openeye Name: 2-[[3-(4-nitrophenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide CAS Name: 2-[[3-(4-nitrophenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]thio]acetamide IUPAC Name: 2-[[3-(4-nitrophenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide Traditional Name: 2-[[4-keto-3-(4-nitrophenyl)-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]thio]acetamide Formula: C14H12N4O4S2 MolecularWeight: 364.39948

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C1N=C(N(C2=O)C3=CC=C(C=C3)[N+](=O)[O-])SCC(=O)N

Isomeric SMILES

C1CSC2=C1N=C(N(C2=O)C3=CC=C(C=C3)[N+](=O)[O-])SCC(=O)N

InChI

InChI=1S/C14H12N4O4S2/c15-11(19)7-24-14-16-10-5-6-23-12(10)13(20)17(14)8-1-3-9(4-2-8)18(21)22/h1-4H,5-7H2,(H2,15,19)