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

Systemtic Name: N-(3-methyl-1,2-oxazol-5-yl)-2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(3-methylisoxazol-5-yl)-2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(3-methyl-5-isoxazolyl)-2-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(3-methyl-1,2-oxazol-5-yl)-2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(3-methylisoxazol-5-yl)-2-[4-(3-nitrophenyl)sulfonylpiperazino]acetamide Formula: C16H19N5O6S MolecularWeight: 409.41696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NOC(=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O6S/c1-12-9-16(27-18-12)17-15(22)11-19-5-7-20(8-6-19)28(25,26)14-4-2-3-13(10-14)21(23)24/h2-4,9-10H,5-8,11H2,1H3,(H,17,22)