(E)-N-[2-[4-(aziridin-1-ylsulfonyl)phenyl]ethyl]but-2-enamide

Systemtic Name: (E)-N-[2-[4-(aziridin-1-ylsulfonyl)phenyl]ethyl]but-2-enamide Openeye Name: (E)-N-[2-[4-(aziridin-1-ylsulfonyl)phenyl]ethyl]but-2-enamide CAS Name: (E)-N-[2-[4-(1-aziridinylsulfonyl)phenyl]ethyl]-2-butenamide IUPAC Name: (E)-N-[2-[4-(aziridin-1-ylsulfonyl)phenyl]ethyl]but-2-enamide Traditional Name: (E)-N-[2-(4-ethyleniminosulfonylphenyl)ethyl]but-2-enamide Formula: C14H18N2O3S MolecularWeight: 294.36932

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)NCCC1=CC=C(C=C1)S(=O)(=O)N2CC2

Isomeric SMILES

C/C=C/C(=O)NCCC1=CC=C(C=C1)S(=O)(=O)N2CC2

InChI

InChI=1S/C14H18N2O3S/c1-2-3-14(17)15-9-8-12-4-6-13(7-5-12)20(18,19)16-10-11-16/h2-7H,8-11H2,1H3,(H,15,17)/b3-2+