3-(4-nitrophenyl)-2-phenacylsulfanyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-(4-nitrophenyl)-2-phenacylsulfanyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one Openeye Name: 3-(4-nitrophenyl)-2-phenacylsulfanyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one CAS Name: 3-(4-nitrophenyl)-2-(phenacylthio)-6,7-dihydrothieno[3,2-d]pyrimidin-4-one IUPAC Name: 3-(4-nitrophenyl)-2-phenacylsulfanyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one Traditional Name: 3-(4-nitrophenyl)-2-(phenacylthio)-6,7-dihydrothieno[3,2-d]pyrimidin-4-one Formula: C20H15N3O4S2 MolecularWeight: 425.4808

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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)C4=CC=CC=C4

Isomeric SMILES

C1CSC2=C1N=C(N(C2=O)C3=CC=C(C=C3)[N+](=O)[O-])SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H15N3O4S2/c24-17(13-4-2-1-3-5-13)12-29-20-21-16-10-11-28-18(16)19(25)22(20)14-6-8-15(9-7-14)23(26)27/h1-9H,10-12H2