N-[(E)-(4-morpholin-4-yl-3-nitro-phenyl)methylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide

Systemtic Name: N-[(E)-(4-morpholin-4-yl-3-nitro-phenyl)methylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide Openeye Name: N-[(E)-(4-morpholino-3-nitro-phenyl)methyleneamino]-4-(2-thienylsulfonylamino)benzamide CAS Name: N-[(E)-[4-(4-morpholinyl)-3-nitrophenyl]methylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide IUPAC Name: N-[(E)-(4-morpholin-4-yl-3-nitrophenyl)methylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide Traditional Name: N-[(E)-(4-morpholino-3-nitro-benzylidene)amino]-4-(2-thienylsulfonylamino)benzamide Formula: C22H21N5O6S2 MolecularWeight: 515.56204

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C=NNC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)/C=N/NC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C22H21N5O6S2/c28-22(17-4-6-18(7-5-17)25-35(31,32)21-2-1-13-34-21)24-23-15-16-3-8-19(20(14-16)27(29)30)26-9-11-33-12-10-26/h1-8,13-15,25H,9-12H2,(H,24,28)/b23-15+