3-(3-methyl-4-nitro-pyrazol-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide

Systemtic Name: 3-(3-methyl-4-nitro-pyrazol-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide Openeye Name: 3-(3-methyl-4-nitro-pyrazol-1-yl)-N-(4-morpholinosulfonylphenyl)propanamide CAS Name: 3-(3-methyl-4-nitro-1-pyrazolyl)-N-[4-(4-morpholinylsulfonyl)phenyl]propanamide IUPAC Name: 3-(3-methyl-4-nitropyrazol-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: 3-(3-methyl-4-nitro-pyrazol-1-yl)-N-(4-morpholinosulfonylphenyl)propionamide Formula: C17H21N5O6S MolecularWeight: 423.44354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H21N5O6S/c1-13-16(22(24)25)12-20(19-13)7-6-17(23)18-14-2-4-15(5-3-14)29(26,27)21-8-10-28-11-9-21/h2-5,12H,6-11H2,1H3,(H,18,23)