3-[[5-(3-nitrophenyl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoate

Systemtic Name: 3-[[5-(3-nitrophenyl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoate Openeye Name: 3-[[5-(3-nitrophenyl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoate CAS Name: 3-[[5-(3-nitrophenyl)-4-thieno[2,3-d]pyrimidinyl]amino]propanoate IUPAC Name: 3-[[5-(3-nitrophenyl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoate Traditional Name: 3-[[5-(3-nitrophenyl)thieno[2,3-d]pyrimidin-4-yl]amino]propionate Formula: C15H11N4O4S- MolecularWeight: 343.33724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC3=NC=NC(=C23)NCCC(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC3=NC=NC(=C23)NCCC(=O)[O-]

InChI

InChI=1S/C15H12N4O4S/c20-12(21)4-5-16-14-13-11(7-24-15(13)18-8-17-14)9-2-1-3-10(6-9)19(22)23/h1-3,6-8H,4-5H2,(H,20,21)(H,16,17,18)/p-1