2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-N-(3-methyl-1,2-oxazol-5-yl)ethanamide

Systemtic Name: 2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-N-(3-methyl-1,2-oxazol-5-yl)ethanamide Openeye Name: N-(3-methylisoxazol-5-yl)-2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(3-methyl-5-isoxazolyl)-2-[4-(2-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: 2-[4-(2-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]-N-(3-methyl-1,2-oxazol-5-yl)acetamide Traditional Name: N-(3-methylisoxazol-5-yl)-2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazino]acetamide Formula: C17H21N5O6S MolecularWeight: 423.44354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC(=NO3)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC(=NO3)C

InChI

InChI=1S/C17H21N5O6S/c1-12-3-4-14(22(24)25)10-15(12)29(26,27)21-7-5-20(6-8-21)11-16(23)18-17-9-13(2)19-28-17/h3-4,9-10H,5-8,11H2,1-2H3,(H,18,23)