1,3,5-trimethyl-N-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)pyrazol-4-amine

Systemtic Name: 1,3,5-trimethyl-N-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)pyrazol-4-amine Openeye Name: 1,3,5-trimethyl-N-(4-morpholinosulfonyl-2-nitro-phenyl)pyrazol-4-amine CAS Name: 1,3,5-trimethyl-N-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]-4-pyrazolamine IUPAC Name: 1,3,5-trimethyl-N-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)pyrazol-4-amine Traditional Name: (4-morpholinosulfonyl-2-nitro-phenyl)-(1,3,5-trimethylpyrazol-4-yl)amine Formula: C16H21N5O5S MolecularWeight: 395.43344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C)C)NC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H21N5O5S/c1-11-16(12(2)19(3)18-11)17-14-5-4-13(10-15(14)21(22)23)27(24,25)20-6-8-26-9-7-20/h4-5,10,17H,6-9H2,1-3H3