N-[3-(4-fluorophenyl)sulfanyl-5-nitro-phenyl]-3,5-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-[3-(4-fluorophenyl)sulfanyl-5-nitro-phenyl]-3,5-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-[3-(4-fluorophenyl)sulfanyl-5-nitro-phenyl]-3,5-dimethyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-[3-[(4-fluorophenyl)thio]-5-nitrophenyl]-3,5-dimethyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-[3-(4-fluorophenyl)sulfanyl-5-nitrophenyl]-3,5-dimethyl-4-oxothieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-[3-[(4-fluorophenyl)thio]-5-nitro-phenyl]-4-keto-3,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H15FN4O4S2 MolecularWeight: 470.496603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)C)C(=O)NC3=CC(=CC(=C3)SC4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)C)C(=O)NC3=CC(=CC(=C3)SC4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C21H15FN4O4S2/c1-11-17-20(23-10-25(2)21(17)28)32-18(11)19(27)24-13-7-14(26(29)30)9-16(8-13)31-15-5-3-12(22)4-6-15/h3-10H,1-2H3,(H,24,27)