2-(4-bromanylpyrazol-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)butanamide

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)butanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-(4-morpholinosulfonylphenyl)butanamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-[4-(4-morpholinylsulfonyl)phenyl]butanamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)butanamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-(4-morpholinosulfonylphenyl)butyramide Formula: C17H21BrN4O4S MolecularWeight: 457.34204

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)N3C=C(C=N3)Br

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)N3C=C(C=N3)Br

InChI

InChI=1S/C17H21BrN4O4S/c1-2-16(22-12-13(18)11-19-22)17(23)20-14-3-5-15(6-4-14)27(24,25)21-7-9-26-10-8-21/h3-6,11-12,16H,2,7-10H2,1H3,(H,20,23)