3-methyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]-5-nitro-imidazol-4-amine

Systemtic Name: 3-methyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]-5-nitro-imidazol-4-amine Openeye Name: 3-methyl-N-[[2-(morpholinosulfonylmethyl)phenyl]methyl]-5-nitro-imidazol-4-amine CAS Name: 3-methyl-N-[[2-(4-morpholinylsulfonylmethyl)phenyl]methyl]-5-nitro-4-imidazolamine IUPAC Name: 3-methyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]-5-nitroimidazol-4-amine Traditional Name: (3-methyl-5-nitro-imidazol-4-yl)-[2-(morpholinosulfonylmethyl)benzyl]amine Formula: C16H21N5O5S MolecularWeight: 395.43344

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1NCC2=CC=CC=C2CS(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1NCC2=CC=CC=C2CS(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H21N5O5S/c1-19-12-18-16(21(22)23)15(19)17-10-13-4-2-3-5-14(13)11-27(24,25)20-6-8-26-9-7-20/h2-5,12,17H,6-11H2,1H3