N-[4-(benzimidazol-1-ylsulfonyl)phenyl]-4-morpholin-4-yl-3,5-dinitro-benzamide

Systemtic Name: N-[4-(benzimidazol-1-ylsulfonyl)phenyl]-4-morpholin-4-yl-3,5-dinitro-benzamide Openeye Name: N-[4-(benzimidazol-1-ylsulfonyl)phenyl]-4-morpholino-3,5-dinitro-benzamide CAS Name: N-[4-(1-benzimidazolylsulfonyl)phenyl]-4-(4-morpholinyl)-3,5-dinitrobenzamide IUPAC Name: N-[4-(benzimidazol-1-ylsulfonyl)phenyl]-4-morpholin-4-yl-3,5-dinitrobenzamide Traditional Name: N-[4-(benzimidazol-1-ylsulfonyl)phenyl]-4-morpholino-3,5-dinitro-benzamide Formula: C24H20N6O8S MolecularWeight: 552.516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4C=NC5=CC=CC=C54)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4C=NC5=CC=CC=C54)[N+](=O)[O-]

InChI

InChI=1S/C24H20N6O8S/c31-24(16-13-21(29(32)33)23(22(14-16)30(34)35)27-9-11-38-12-10-27)26-17-5-7-18(8-6-17)39(36,37)28-15-25-19-3-1-2-4-20(19)28/h1-8,13-15H,9-12H2,(H,26,31)