1-[(4-aminocarbonylphenyl)-(2-cyanoaziridin-1-yl)methyl]aziridine-2-carboxamide

Systemtic Name: 1-[(4-aminocarbonylphenyl)-(2-cyanoaziridin-1-yl)methyl]aziridine-2-carboxamide Openeye Name: 1-[(4-carbamoylphenyl)-(2-cyanoaziridin-1-yl)methyl]aziridine-2-carboxamide CAS Name: 1-[(4-carbamoylphenyl)-(2-cyano-1-aziridinyl)methyl]-2-aziridinecarboxamide IUPAC Name: 1-[(4-carbamoylphenyl)-(2-cyanoaziridin-1-yl)methyl]aziridine-2-carboxamide Traditional Name: 1-[(4-carbamoylphenyl)-(2-cyanoethylenimin-1-yl)methyl]ethylenimine-2-carboxamide Formula: C14H15N5O2 MolecularWeight: 285.3012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(N1C(C2=CC=C(C=C2)C(=O)N)N3CC3C(=O)N)C#N

Isomeric SMILES

C1C(N1C(C2=CC=C(C=C2)C(=O)N)N3CC3C(=O)N)C#N

InChI

InChI=1S/C14H15N5O2/c15-5-10-6-18(10)14(19-7-11(19)13(17)21)9-3-1-8(2-4-9)12(16)20/h1-4,10-11,14H,6-7H2,(H2,16,20)(H2,17,21)