5-(azidomethyl)-3-[3-fluoranyl-4-(1-isothiocyanato-1-piperazin-1-yl-propyl)phenyl]-1,3-oxazolidin-2-one

Systemtic Name: 5-(azidomethyl)-3-[3-fluoranyl-4-(1-isothiocyanato-1-piperazin-1-yl-propyl)phenyl]-1,3-oxazolidin-2-one Openeye Name: 5-(azidomethyl)-3-[3-fluoro-4-(1-isothiocyanato-1-piperazin-1-yl-propyl)phenyl]oxazolidin-2-one CAS Name: 5-(azidomethyl)-3-[3-fluoro-4-[1-isothiocyanato-1-(1-piperazinyl)propyl]phenyl]-2-oxazolidinone IUPAC Name: 5-(azidomethyl)-3-[3-fluoro-4-(1-isothiocyanato-1-piperazin-1-ylpropyl)phenyl]-1,3-oxazolidin-2-one Traditional Name: 5-(azidomethyl)-3-[3-fluoro-4-(1-isothiocyanato-1-piperazino-propyl)phenyl]oxazolidin-2-one Formula: C18H22FN7O2S MolecularWeight: 419.476383

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=C(C=C1)N2CC(OC2=O)CN=[N+]=[N-])F)(N=C=S)N3CCNCC3

Isomeric SMILES

CCC(C1=C(C=C(C=C1)N2CC(OC2=O)CN=[N+]=[N-])F)(N=C=S)N3CCNCC3

InChI

InChI=1S/C18H22FN7O2S/c1-2-18(22-12-29,25-7-5-21-6-8-25)15-4-3-13(9-16(15)19)26-11-14(10-23-24-20)28-17(26)27/h3-4,9,14,21H,2,5-8,10-11H2,1H3