2-(5-methyl-3-nitro-pyrazol-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)butanamide

Systemtic Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)butanamide Openeye Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-(4-morpholinosulfonylphenyl)butanamide CAS Name: 2-(5-methyl-3-nitro-1-pyrazolyl)-N-[4-(4-morpholinylsulfonyl)phenyl]butanamide IUPAC Name: 2-(5-methyl-3-nitropyrazol-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)butanamide Traditional Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-(4-morpholinosulfonylphenyl)butyramide Formula: C18H23N5O6S MolecularWeight: 437.47012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N5O6S/c1-3-16(22-13(2)12-17(20-22)23(25)26)18(24)19-14-4-6-15(7-5-14)30(27,28)21-8-10-29-11-9-21/h4-7,12,16H,3,8-11H2,1-2H3,(H,19,24)