2-(3-methoxy-4-nitro-pyrazol-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide

Systemtic Name: 2-(3-methoxy-4-nitro-pyrazol-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide Openeye Name: 2-(3-methoxy-4-nitro-pyrazol-1-yl)-N-(4-morpholinosulfonylphenyl)propanamide CAS Name: 2-(3-methoxy-4-nitro-1-pyrazolyl)-N-[4-(4-morpholinylsulfonyl)phenyl]propanamide IUPAC Name: 2-(3-methoxy-4-nitropyrazol-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: 2-(3-methoxy-4-nitro-pyrazol-1-yl)-N-(4-morpholinosulfonylphenyl)propionamide Formula: C17H21N5O7S MolecularWeight: 439.44294

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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)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H21N5O7S/c1-12(21-11-15(22(24)25)17(19-21)28-2)16(23)18-13-3-5-14(6-4-13)30(26,27)20-7-9-29-10-8-20/h3-6,11-12H,7-10H2,1-2H3,(H,18,23)