ethyl 3-[[1-oxidanylidene-3-phenyl-1-(2-pyridin-2-ylethylamino)propan-2-yl]carbamoyl]aziridine-2-carboxylate

Systemtic Name: ethyl 3-[[1-oxidanylidene-3-phenyl-1-(2-pyridin-2-ylethylamino)propan-2-yl]carbamoyl]aziridine-2-carboxylate Openeye Name: ethyl 3-[[1-benzyl-2-oxo-2-[2-(2-pyridyl)ethylamino]ethyl]carbamoyl]aziridine-2-carboxylate CAS Name: 3-[oxo-[[1-oxo-3-phenyl-1-[2-(2-pyridinyl)ethylamino]propan-2-yl]amino]methyl]-2-aziridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[1-oxo-3-phenyl-1-(2-pyridin-2-ylethylamino)propan-2-yl]carbamoyl]aziridine-2-carboxylate Traditional Name: 3-[[1-benzyl-2-keto-2-[2-(2-pyridyl)ethylamino]ethyl]carbamoyl]ethylenimine-2-carboxylic acid ethyl ester Formula: C22H26N4O4 MolecularWeight: 410.46624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N1)C(=O)NC(CC2=CC=CC=C2)C(=O)NCCC3=CC=CC=N3

Isomeric SMILES

CCOC(=O)C1C(N1)C(=O)NC(CC2=CC=CC=C2)C(=O)NCCC3=CC=CC=N3

InChI

InChI=1S/C22H26N4O4/c1-2-30-22(29)19-18(26-19)21(28)25-17(14-15-8-4-3-5-9-15)20(27)24-13-11-16-10-6-7-12-23-16/h3-10,12,17-19,26H,2,11,13-14H2,1H3,(H,24,27)(H,25,28)