N-(5-methoxy-2-methyl-4-nitro-phenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(5-methoxy-2-methyl-4-nitro-phenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide Openeye Name: N-(5-methoxy-2-methyl-4-nitro-phenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-acetamide CAS Name: N-(5-methoxy-2-methyl-4-nitrophenyl)-2-(4-thieno[2,3-d]pyrimidinylthio)acetamide IUPAC Name: N-(5-methoxy-2-methyl-4-nitrophenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetamide Traditional Name: N-(5-methoxy-2-methyl-4-nitro-phenyl)-2-(thieno[2,3-d]pyrimidin-4-ylthio)acetamide Formula: C16H14N4O4S2 MolecularWeight: 390.43676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)CSC2=NC=NC3=C2C=CS3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)CSC2=NC=NC3=C2C=CS3)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O4S2/c1-9-5-12(20(22)23)13(24-2)6-11(9)19-14(21)7-26-16-10-3-4-25-15(10)17-8-18-16/h3-6,8H,7H2,1-2H3,(H,19,21)