2-(4-chloranyl-3-nitro-phenyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(4-chloranyl-3-nitro-phenyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(4-chloro-3-nitro-phenyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(4-chloro-3-nitrophenyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(4-chloro-3-nitrophenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(4-chloro-3-nitro-phenyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C12H6ClN3O3S MolecularWeight: 307.71234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=NC3=C(C=CS3)C(=O)N2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1C2=NC3=C(C=CS3)C(=O)N2)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H6ClN3O3S/c13-8-2-1-6(5-9(8)16(18)19)10-14-11(17)7-3-4-20-12(7)15-10/h1-5H,(H,14,15,17)