N-(4-morpholin-4-ylsulfonylphenyl)-2-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-(4-morpholin-4-ylsulfonylphenyl)-2-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-(4-morpholinosulfonylphenyl)-2-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[4-(4-morpholinylsulfonyl)phenyl]-2-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(4-morpholin-4-ylsulfonylphenyl)-2-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-(4-morpholinosulfonylphenyl)-2-(4-nitropyrazol-1-yl)propionamide Formula: C16H19N5O6S MolecularWeight: 409.41696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)N3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O6S/c1-12(20-11-14(10-17-20)21(23)24)16(22)18-13-2-4-15(5-3-13)28(25,26)19-6-8-27-9-7-19/h2-5,10-12H,6-9H2,1H3,(H,18,22)