N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2-(4-nitroimidazol-1-yl)ethanamide

Systemtic Name: N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2-(4-nitroimidazol-1-yl)ethanamide Openeye Name: N-[(4-morpholinosulfonylphenyl)methyl]-2-(4-nitroimidazol-1-yl)acetamide CAS Name: N-[[4-(4-morpholinylsulfonyl)phenyl]methyl]-2-(4-nitro-1-imidazolyl)acetamide IUPAC Name: N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2-(4-nitroimidazol-1-yl)acetamide Traditional Name: N-(4-morpholinosulfonylbenzyl)-2-(4-nitroimidazol-1-yl)acetamide Formula: C16H19N5O6S MolecularWeight: 409.41696

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)CN3C=C(N=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)CN3C=C(N=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O6S/c22-16(11-19-10-15(18-12-19)21(23)24)17-9-13-1-3-14(4-2-13)28(25,26)20-5-7-27-8-6-20/h1-4,10,12H,5-9,11H2,(H,17,22)