3-azanyl-4-(1,3-benzodioxol-5-yl)-N-(4-nitrophenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-4-(1,3-benzodioxol-5-yl)-N-(4-nitrophenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-4-(1,3-benzodioxol-5-yl)-N-(4-nitrophenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-4-(1,3-benzodioxol-5-yl)-N-(4-nitrophenyl)-6-phenyl-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-4-(1,3-benzodioxol-5-yl)-N-(4-nitrophenyl)-6-phenylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-4-(1,3-benzodioxol-5-yl)-N-(4-nitrophenyl)-6-phenyl-thieno[2,3-b]pyridine-2-carboxamide Formula: C27H18N4O5S MolecularWeight: 510.52062

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC(=NC4=C3C(=C(S4)C(=O)NC5=CC=C(C=C5)[N+](=O)[O-])N)C6=CC=CC=C6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC(=NC4=C3C(=C(S4)C(=O)NC5=CC=C(C=C5)[N+](=O)[O-])N)C6=CC=CC=C6

InChI

InChI=1S/C27H18N4O5S/c28-24-23-19(16-6-11-21-22(12-16)36-14-35-21)13-20(15-4-2-1-3-5-15)30-27(23)37-25(24)26(32)29-17-7-9-18(10-8-17)31(33)34/h1-13H,14,28H2,(H,29,32)