2-[4-(2-bromophenyl)sulfonylpiperazin-1-yl]-N-(3-methyl-1,2-oxazol-5-yl)propanamide

Systemtic Name: 2-[4-(2-bromophenyl)sulfonylpiperazin-1-yl]-N-(3-methyl-1,2-oxazol-5-yl)propanamide Openeye Name: 2-[4-(2-bromophenyl)sulfonylpiperazin-1-yl]-N-(3-methylisoxazol-5-yl)propanamide CAS Name: 2-[4-(2-bromophenyl)sulfonyl-1-piperazinyl]-N-(3-methyl-5-isoxazolyl)propanamide IUPAC Name: 2-[4-(2-bromophenyl)sulfonylpiperazin-1-yl]-N-(3-methyl-1,2-oxazol-5-yl)propanamide Traditional Name: 2-[4-(2-bromophenyl)sulfonylpiperazino]-N-(3-methylisoxazol-5-yl)propionamide Formula: C17H21BrN4O4S MolecularWeight: 457.34204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)NC(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Br

Isomeric SMILES

CC1=NOC(=C1)NC(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Br

InChI

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