N-[2,6-dimethyl-5-(4-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[2,6-dimethyl-5-(4-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]-5-nitro-furan-2-carboxamide Openeye Name: N-[2,6-dimethyl-4-oxo-5-(p-tolyl)thieno[2,3-d]pyrimidin-3-yl]-5-nitro-furan-2-carboxamide CAS Name: N-[2,6-dimethyl-5-(4-methylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[2,6-dimethyl-5-(4-methylphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]-5-nitrofuran-2-carboxamide Traditional Name: N-[4-keto-2,6-dimethyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-3-yl]-5-nitro-2-furamide Formula: C20H16N4O5S MolecularWeight: 424.42984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)N(C(=N3)C)NC(=O)C4=CC=C(O4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)N(C(=N3)C)NC(=O)C4=CC=C(O4)[N+](=O)[O-])C

InChI

InChI=1S/C20H16N4O5S/c1-10-4-6-13(7-5-10)16-11(2)30-19-17(16)20(26)23(12(3)21-19)22-18(25)14-8-9-15(29-14)24(27)28/h4-9H,1-3H3,(H,22,25)