2-methyl-N-[2-[3-[(2-nitro-4-sulfamoyl-phenyl)amino]propanoylamino]ethyl]propanamide

Systemtic Name: 2-methyl-N-[2-[3-[(2-nitro-4-sulfamoyl-phenyl)amino]propanoylamino]ethyl]propanamide Openeye Name: 2-methyl-N-[2-[3-(2-nitro-4-sulfamoyl-anilino)propanoylamino]ethyl]propanamide CAS Name: 2-methyl-N-[2-[[3-(2-nitro-4-sulfamoylanilino)-1-oxopropyl]amino]ethyl]propanamide IUPAC Name: 2-methyl-N-[2-[3-(2-nitro-4-sulfamoylanilino)propanoylamino]ethyl]propanamide Traditional Name: 2-methyl-N-[2-[3-(2-nitro-4-sulfamoyl-anilino)propanoylamino]ethyl]propionamide Formula: C15H23N5O6S MolecularWeight: 401.43802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)CCNC1=C(C=C(C=C1)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)CCNC1=C(C=C(C=C1)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C15H23N5O6S/c1-10(2)15(22)19-8-7-18-14(21)5-6-17-12-4-3-11(27(16,25)26)9-13(12)20(23)24/h3-4,9-10,17H,5-8H2,1-2H3,(H,18,21)(H,19,22)(H2,16,25,26)