2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-(4-fluoranyl-3-nitro-phenyl)propanamide

Systemtic Name: 2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-(4-fluoranyl-3-nitro-phenyl)propanamide Openeye Name: 2-(1-amino-4-phenyl-imidazol-2-yl)sulfanyl-N-(4-fluoro-3-nitro-phenyl)propanamide CAS Name: 2-[(1-amino-4-phenyl-2-imidazolyl)thio]-N-(4-fluoro-3-nitrophenyl)propanamide IUPAC Name: 2-(1-amino-4-phenylimidazol-2-yl)sulfanyl-N-(4-fluoro-3-nitrophenyl)propanamide Traditional Name: 2-[(1-amino-4-phenyl-imidazol-2-yl)thio]-N-(4-fluoro-3-nitro-phenyl)propionamide Formula: C18H16FN5O3S MolecularWeight: 401.414743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)F)[N+](=O)[O-])SC2=NC(=CN2N)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)F)[N+](=O)[O-])SC2=NC(=CN2N)C3=CC=CC=C3

InChI

InChI=1S/C18H16FN5O3S/c1-11(17(25)21-13-7-8-14(19)16(9-13)24(26)27)28-18-22-15(10-23(18)20)12-5-3-2-4-6-12/h2-11H,20H2,1H3,(H,21,25)