(2S)-2-azanyl-N-[2-[2-(2-bromanylethanoylamino)ethyldisulfanyl]ethyl]-3-phenyl-propanamide

Systemtic Name: (2S)-2-azanyl-N-[2-[2-(2-bromanylethanoylamino)ethyldisulfanyl]ethyl]-3-phenyl-propanamide Openeye Name: (2S)-2-amino-N-[2-[2-[(2-bromoacetyl)amino]ethyldisulfanyl]ethyl]-3-phenyl-propanamide CAS Name: (2S)-2-amino-N-[2-[2-[(2-bromo-1-oxoethyl)amino]ethyldisulfanyl]ethyl]-3-phenylpropanamide IUPAC Name: (2S)-2-amino-N-[2-[2-[(2-bromoacetyl)amino]ethyldisulfanyl]ethyl]-3-phenylpropanamide Traditional Name: (2S)-2-amino-N-[2-[2-[(2-bromoacetyl)amino]ethyldisulfanyl]ethyl]-3-phenyl-propionamide Formula: C15H22BrN3O2S2 MolecularWeight: 420.38808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCCSSCCNC(=O)CBr)N

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NCCSSCCNC(=O)CBr)N

InChI

InChI=1S/C15H22BrN3O2S2/c16-11-14(20)18-6-8-22-23-9-7-19-15(21)13(17)10-12-4-2-1-3-5-12/h1-5,13H,6-11,17H2,(H,18,20)(H,19,21)/t13-/m0/s1