N-[(E)-1-(4-imidazol-1-ylphenyl)ethylideneamino]-2-morpholin-4-ylsulfonyl-4-nitro-aniline

Systemtic Name: N-[(E)-1-(4-imidazol-1-ylphenyl)ethylideneamino]-2-morpholin-4-ylsulfonyl-4-nitro-aniline Openeye Name: N-[(E)-1-(4-imidazol-1-ylphenyl)ethylideneamino]-2-morpholinosulfonyl-4-nitro-aniline CAS Name: N-[(E)-1-[4-(1-imidazolyl)phenyl]ethylideneamino]-2-(4-morpholinylsulfonyl)-4-nitroaniline IUPAC Name: N-[(E)-1-(4-imidazol-1-ylphenyl)ethylideneamino]-2-morpholin-4-ylsulfonyl-4-nitroaniline Traditional Name: [(E)-1-(4-imidazol-1-ylphenyl)ethylideneamino]-(2-morpholinosulfonyl-4-nitro-phenyl)amine Formula: C21H22N6O5S MolecularWeight: 470.50158

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCOCC2)C3=CC=C(C=C3)N4C=CN=C4

Isomeric SMILES

C/C(=N\NC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCOCC2)/C3=CC=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C21H22N6O5S/c1-16(17-2-4-18(5-3-17)25-9-8-22-15-25)23-24-20-7-6-19(27(28)29)14-21(20)33(30,31)26-10-12-32-13-11-26/h2-9,14-15,24H,10-13H2,1H3/b23-16+