2-(1-methylimidazol-2-yl)sulfanyl-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 2-(1-methylimidazol-2-yl)sulfanyl-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide Openeye Name: 2-(1-methylimidazol-2-yl)sulfanyl-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide CAS Name: 2-[(1-methyl-2-imidazolyl)thio]-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide IUPAC Name: 2-(1-methylimidazol-2-yl)sulfanyl-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide Traditional Name: 2-[(1-methylimidazol-2-yl)thio]-N-[4-nitro-2-(trifluoromethyl)phenyl]propionamide Formula: C14H13F3N4O3S MolecularWeight: 374.33823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])C(F)(F)F)SC2=NC=CN2C

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])C(F)(F)F)SC2=NC=CN2C

InChI

InChI=1S/C14H13F3N4O3S/c1-8(25-13-18-5-6-20(13)2)12(22)19-11-4-3-9(21(23)24)7-10(11)14(15,16)17/h3-8H,1-2H3,(H,19,22)