(3-bromophenyl)-(3,5-dimethyl-4-morpholin-4-ylsulfonyl-pyrazol-1-yl)methanone

Systemtic Name: (3-bromophenyl)-(3,5-dimethyl-4-morpholin-4-ylsulfonyl-pyrazol-1-yl)methanone Openeye Name: (3-bromophenyl)-(3,5-dimethyl-4-morpholinosulfonyl-pyrazol-1-yl)methanone CAS Name: (3-bromophenyl)-[3,5-dimethyl-4-(4-morpholinylsulfonyl)-1-pyrazolyl]methanone IUPAC Name: (3-bromophenyl)-(3,5-dimethyl-4-morpholin-4-ylsulfonylpyrazol-1-yl)methanone Traditional Name: (3-bromophenyl)-(3,5-dimethyl-4-morpholinosulfonyl-pyrazol-1-yl)methanone Formula: C16H18BrN3O4S MolecularWeight: 428.30082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)C2=CC(=CC=C2)Br)C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C(=NN1C(=O)C2=CC(=CC=C2)Br)C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C16H18BrN3O4S/c1-11-15(25(22,23)19-6-8-24-9-7-19)12(2)20(18-11)16(21)13-4-3-5-14(17)10-13/h3-5,10H,6-9H2,1-2H3