ethyl 2-(2-aminocarbonylaziridin-1-yl)-3-(phenylmethylsulfanyl)propanoate

Systemtic Name: ethyl 2-(2-aminocarbonylaziridin-1-yl)-3-(phenylmethylsulfanyl)propanoate Openeye Name: ethyl 3-benzylsulfanyl-2-(2-carbamoylaziridin-1-yl)propanoate CAS Name: 2-(2-carbamoyl-1-aziridinyl)-3-(phenylmethylthio)propanoic acid ethyl ester IUPAC Name: ethyl 3-benzylsulfanyl-2-(2-carbamoylaziridin-1-yl)propanoate Traditional Name: 3-(benzylthio)-2-(2-carbamoylethylenimin-1-yl)propionic acid ethyl ester Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CSCC1=CC=CC=C1)N2CC2C(=O)N

Isomeric SMILES

CCOC(=O)C(CSCC1=CC=CC=C1)N2CC2C(=O)N

InChI

InChI=1S/C15H20N2O3S/c1-2-20-15(19)13(17-8-12(17)14(16)18)10-21-9-11-6-4-3-5-7-11/h3-7,12-13H,2,8-10H2,1H3,(H2,16,18)