N-(4-morpholin-4-ylsulfonylphenyl)-3-(3-nitropyrazol-1-yl)propanamide

Systemtic Name: N-(4-morpholin-4-ylsulfonylphenyl)-3-(3-nitropyrazol-1-yl)propanamide Openeye Name: N-(4-morpholinosulfonylphenyl)-3-(3-nitropyrazol-1-yl)propanamide CAS Name: N-[4-(4-morpholinylsulfonyl)phenyl]-3-(3-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(4-morpholin-4-ylsulfonylphenyl)-3-(3-nitropyrazol-1-yl)propanamide Traditional Name: N-(4-morpholinosulfonylphenyl)-3-(3-nitropyrazol-1-yl)propionamide Formula: C16H19N5O6S MolecularWeight: 409.41696

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCN3C=CC(=N3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCN3C=CC(=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O6S/c22-16(6-8-19-7-5-15(18-19)21(23)24)17-13-1-3-14(4-2-13)28(25,26)20-9-11-27-12-10-20/h1-5,7H,6,8-12H2,(H,17,22)