5-nitro-N-[[4-(5-nitropyridin-2-yl)oxyphenyl]methylideneamino]-1-benzothiophene-2-carboxamide

Systemtic Name: 5-nitro-N-[[4-(5-nitropyridin-2-yl)oxyphenyl]methylideneamino]-1-benzothiophene-2-carboxamide Openeye Name: 5-nitro-N-[[4-[(5-nitro-2-pyridyl)oxy]phenyl]methyleneamino]benzothiophene-2-carboxamide CAS Name: 5-nitro-N-[[4-[(5-nitro-2-pyridinyl)oxy]phenyl]methylideneamino]-1-benzothiophene-2-carboxamide IUPAC Name: 5-nitro-N-[[4-(5-nitropyridin-2-yl)oxyphenyl]methylideneamino]-1-benzothiophene-2-carboxamide Traditional Name: 5-nitro-N-[[4-[(5-nitro-2-pyridyl)oxy]benzylidene]amino]benzothiophene-2-carboxamide Formula: C21H13N5O6S MolecularWeight: 463.42282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])OC4=NC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])OC4=NC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H13N5O6S/c27-21(19-10-14-9-15(25(28)29)3-7-18(14)33-19)24-23-11-13-1-5-17(6-2-13)32-20-8-4-16(12-22-20)26(30)31/h1-12H,(H,24,27)