Nombre: tert-butyl 4-{4-[5-(2-nitrophenyl)-4,5-dihydro-1,2-oxazol-3-yl]-1,3-thiazol-2-yl}piperidine-1-carboxylate

IUPAC: tert-butyl 4-[4-[5-(2-nitrophenyl)-4,5-dihydro-1,2-oxazol-3-yl]-1,3-thiazol-2-yl]piperidine-1-carboxylate

SMILES: CC(C)(C)OC(=O)N1CCC(c2nc(C3=NOC(c4ccccc4[N+](=O)[O-])C3)cs2)CC1

Canonical SMILES: CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C3=NOC(C3)C4=CC=CC=C4[N+](=O)[O-]

Fórmula molecular: C22H26N4O5S

Masa molecular: 458.50

InChIKey: PAWSNHKPVNJCFW-UHFFFAOYSA-N

InChI:

InChI=1S/C22H26N4O5S/c1-22(2,3)30-21(27)25-10-8-14(9-11-25)20-23-17(13-32-20)16-12-19(31-24-16)15-6-4-5-7-18(15)26(28)29/h4-7,13-14,19H,8-12H2,1-3H3

Sinónimos

SCHEMBL2003896PAWSNHKPVNJCFW-UHFFFAOYSA-Ntert-Butyl 4-{4-[5-(2-nitrophenyl)-4,5-dihydro-1,2-oxazol-3-yl]-1,3-thiazol-2-yl}piperidine-1-carboxylate