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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CCN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CCN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O6S/c1-13-11-16(19-28-13)18-17(23)5-6-20-7-9-21(10-8-20)29(26,27)15-4-2-3-14(12-15)22(24)25/h2-4,11-12H,5-10H2,1H3,(H,18,19,23)