3-azanyl-N-(4-chloranyl-3-nitro-phenyl)-6-(4-ethoxyphenyl)-4-phenyl-thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-N-(4-chloranyl-3-nitro-phenyl)-6-(4-ethoxyphenyl)-4-phenyl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-N-(4-chloro-3-nitro-phenyl)-6-(4-ethoxyphenyl)-4-phenyl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-N-(4-chloro-3-nitrophenyl)-6-(4-ethoxyphenyl)-4-phenyl-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-N-(4-chloro-3-nitrophenyl)-6-(4-ethoxyphenyl)-4-phenylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-N-(4-chloro-3-nitro-phenyl)-4-phenyl-6-p-phenetyl-thieno[2,3-b]pyridine-2-carboxamide Formula: C28H21ClN4O4S MolecularWeight: 545.00874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=C(C(=C2)C4=CC=CC=C4)C(=C(S3)C(=O)NC5=CC(=C(C=C5)Cl)[N+](=O)[O-])N

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=C(C(=C2)C4=CC=CC=C4)C(=C(S3)C(=O)NC5=CC(=C(C=C5)Cl)[N+](=O)[O-])N

InChI

InChI=1S/C28H21ClN4O4S/c1-2-37-19-11-8-17(9-12-19)22-15-20(16-6-4-3-5-7-16)24-25(30)26(38-28(24)32-22)27(34)31-18-10-13-21(29)23(14-18)33(35)36/h3-15H,2,30H2,1H3,(H,31,34)