N-(3-fluoranyl-4-methoxy-phenyl)-3-(2-methyl-4-nitro-imidazol-1-yl)-N-propylsulfonyl-propanamide

Systemtic Name: N-(3-fluoranyl-4-methoxy-phenyl)-3-(2-methyl-4-nitro-imidazol-1-yl)-N-propylsulfonyl-propanamide Openeye Name: N-(3-fluoro-4-methoxy-phenyl)-3-(2-methyl-4-nitro-imidazol-1-yl)-N-propylsulfonyl-propanamide CAS Name: N-(3-fluoro-4-methoxyphenyl)-3-(2-methyl-4-nitro-1-imidazolyl)-N-propylsulfonylpropanamide IUPAC Name: N-(3-fluoro-4-methoxyphenyl)-3-(2-methyl-4-nitroimidazol-1-yl)-N-propylsulfonylpropanamide Traditional Name: N-(3-fluoro-4-methoxy-phenyl)-3-(2-methyl-4-nitro-imidazol-1-yl)-N-propylsulfonyl-propionamide Formula: C17H21FN4O6S MolecularWeight: 428.435243

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N(C1=CC(=C(C=C1)OC)F)C(=O)CCN2C=C(N=C2C)[N+](=O)[O-]

Isomeric SMILES

CCCS(=O)(=O)N(C1=CC(=C(C=C1)OC)F)C(=O)CCN2C=C(N=C2C)[N+](=O)[O-]

InChI

InChI=1S/C17H21FN4O6S/c1-4-9-29(26,27)21(13-5-6-15(28-3)14(18)10-13)17(23)7-8-20-11-16(22(24)25)19-12(20)2/h5-6,10-11H,4,7-9H2,1-3H3