3-methyl-2-[(3-nitrophenyl)methylsulfanyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-methyl-2-[(3-nitrophenyl)methylsulfanyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-methyl-2-[(3-nitrophenyl)methylsulfanyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-methyl-2-[(3-nitrophenyl)methylthio]-6-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-methyl-2-[(3-nitrophenyl)methylsulfanyl]-6-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-methyl-2-[(3-nitrobenzyl)thio]-6-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C20H15N3O3S2 MolecularWeight: 409.4814

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC3=CC(=CC=C3)[N+](=O)[O-])SC(=C2)C4=CC=CC=C4

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC3=CC(=CC=C3)[N+](=O)[O-])SC(=C2)C4=CC=CC=C4

InChI

InChI=1S/C20H15N3O3S2/c1-22-19(24)16-11-17(14-7-3-2-4-8-14)28-18(16)21-20(22)27-12-13-6-5-9-15(10-13)23(25)26/h2-11H,12H2,1H3