3-nitro-4-thieno[2,3-d]pyrimidin-4-ylsulfanyl-benzamide

Systemtic Name: 3-nitro-4-thieno[2,3-d]pyrimidin-4-ylsulfanyl-benzamide Openeye Name: 3-nitro-4-thieno[2,3-d]pyrimidin-4-ylsulfanyl-benzamide CAS Name: 3-nitro-4-(4-thieno[2,3-d]pyrimidinylthio)benzamide IUPAC Name: 3-nitro-4-thieno[2,3-d]pyrimidin-4-ylsulfanylbenzamide Traditional Name: 3-nitro-4-(thieno[2,3-d]pyrimidin-4-ylthio)benzamide Formula: C13H8N4O3S2 MolecularWeight: 332.35762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])SC2=NC=NC3=C2C=CS3

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])SC2=NC=NC3=C2C=CS3

InChI

InChI=1S/C13H8N4O3S2/c14-11(18)7-1-2-10(9(5-7)17(19)20)22-13-8-3-4-21-12(8)15-6-16-13/h1-6H,(H2,14,18)