N-[(Z)-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylideneamino]-2-morpholin-4-ylsulfonyl-4-nitro-aniline

Systemtic Name: N-[(Z)-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylideneamino]-2-morpholin-4-ylsulfonyl-4-nitro-aniline Openeye Name: N-[(Z)-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]-2-morpholinosulfonyl-4-nitro-aniline CAS Name: N-[(Z)-(3,5-dimethyl-1-phenyl-4-pyrazolyl)methylideneamino]-2-(4-morpholinylsulfonyl)-4-nitroaniline IUPAC Name: N-[(Z)-(3,5-dimethyl-1-phenylpyrazol-4-yl)methylideneamino]-2-morpholin-4-ylsulfonyl-4-nitroaniline Traditional Name: [(Z)-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]-(2-morpholinosulfonyl-4-nitro-phenyl)amine Formula: C22H24N6O5S MolecularWeight: 484.52816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=NNC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)/C=N\NC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H24N6O5S/c1-16-20(17(2)27(25-16)18-6-4-3-5-7-18)15-23-24-21-9-8-19(28(29)30)14-22(21)34(31,32)26-10-12-33-13-11-26/h3-9,14-15,24H,10-13H2,1-2H3/b23-15-