2-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]sulfanyl]-N-(4-nitrophenyl)propanamide

Systemtic Name: 2-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]sulfanyl]-N-(4-nitrophenyl)propanamide Openeye Name: 2-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]sulfanyl]-N-(4-nitrophenyl)propanamide CAS Name: 2-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]thio]-N-(4-nitrophenyl)propanamide IUPAC Name: 2-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]sulfanyl]-N-(4-nitrophenyl)propanamide Traditional Name: 2-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]thio]-N-(4-nitrophenyl)propionamide Formula: C18H15FN4O3S MolecularWeight: 386.400103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=NC=C(N2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=NC=C(N2)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H15FN4O3S/c1-11(17(24)21-14-6-8-15(9-7-14)23(25)26)27-18-20-10-16(22-18)12-2-4-13(19)5-3-12/h2-11H,1H3,(H,20,22)(H,21,24)