N-(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-3-methyl-4-nitro-benzamide

Systemtic Name: N-(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-3-methyl-4-nitro-benzamide Openeye Name: N-(6-ethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)-3-methyl-4-nitro-benzamide CAS Name: N-(6-ethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)-3-methyl-4-nitrobenzamide IUPAC Name: N-(6-ethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)-3-methyl-4-nitrobenzamide Traditional Name: N-(6-ethyl-4-keto-thieno[2,3-d]pyrimidin-3-yl)-3-methyl-4-nitro-benzamide Formula: C16H14N4O4S MolecularWeight: 358.37176

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN(C2=O)NC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCC1=CC2=C(S1)N=CN(C2=O)NC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C16H14N4O4S/c1-3-11-7-12-15(25-11)17-8-19(16(12)22)18-14(21)10-4-5-13(20(23)24)9(2)6-10/h4-8H,3H2,1-2H3,(H,18,21)