ethyl 4-[[1-[(5-fluoranyl-2-methyl-phenyl)methyl]aziridin-2-yl]carbonylamino]-1-methyl-imidazole-2-carboxylate

Systemtic Name: ethyl 4-[[1-[(5-fluoranyl-2-methyl-phenyl)methyl]aziridin-2-yl]carbonylamino]-1-methyl-imidazole-2-carboxylate Openeye Name: ethyl 4-[[1-[(5-fluoro-2-methyl-phenyl)methyl]aziridine-2-carbonyl]amino]-1-methyl-imidazole-2-carboxylate CAS Name: 4-[[[1-[(5-fluoro-2-methylphenyl)methyl]-2-aziridinyl]-oxomethyl]amino]-1-methyl-2-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[1-[(5-fluoro-2-methylphenyl)methyl]aziridine-2-carbonyl]amino]-1-methylimidazole-2-carboxylate Traditional Name: 4-[[1-(5-fluoro-2-methyl-benzyl)ethylenimine-2-carbonyl]amino]-1-methyl-imidazole-2-carboxylic acid ethyl ester Formula: C18H21FN4O3 MolecularWeight: 360.382743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=CN1C)NC(=O)C2CN2CC3=C(C=CC(=C3)F)C

Isomeric SMILES

CCOC(=O)C1=NC(=CN1C)NC(=O)C2CN2CC3=C(C=CC(=C3)F)C

InChI

InChI=1S/C18H21FN4O3/c1-4-26-18(25)16-20-15(10-22(16)3)21-17(24)14-9-23(14)8-12-7-13(19)6-5-11(12)2/h5-7,10,14H,4,8-9H2,1-3H3,(H,21,24)