2-[(4-fluoranyl-2-nitro-phenyl)sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(4-fluoranyl-2-nitro-phenyl)sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(4-fluoro-2-nitro-phenyl)sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(4-fluoro-2-nitrophenyl)thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(4-fluoro-2-nitrophenyl)sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(4-fluoro-2-nitro-phenyl)thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C15H12FN3O3S2 MolecularWeight: 365.402483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=C(C=C(C=C3)F)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=C(C=C(C=C3)F)[N+](=O)[O-])C

InChI

InChI=1S/C15H12FN3O3S2/c1-7-8(2)24-15-13(7)14(20)17-12(18-15)6-23-11-4-3-9(16)5-10(11)19(21)22/h3-5H,6H2,1-2H3,(H,17,18,20)