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

Systemtic Name: 3-(2-chloranyl-4-nitro-phenyl)-2-methyl-6-nitro-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(2-chloro-4-nitro-phenyl)-2-methyl-6-nitro-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(2-chloro-4-nitrophenyl)-2-methyl-6-nitro-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(2-chloro-4-nitrophenyl)-2-methyl-6-nitrothieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(2-chloro-4-nitro-phenyl)-2-methyl-6-nitro-thieno[2,3-d]pyrimidin-4-one Formula: C13H7ClN4O5S MolecularWeight: 366.73648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(S2)[N+](=O)[O-])C(=O)N1C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=NC2=C(C=C(S2)[N+](=O)[O-])C(=O)N1C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H7ClN4O5S/c1-6-15-12-8(5-11(24-12)18(22)23)13(19)16(6)10-3-2-7(17(20)21)4-9(10)14/h2-5H,1H3