2-(6-NITRO-1H-BENZOIMIDAZOL-2-YLSULFANYLMETHYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER

CAS No.
CCD No.
CCD06172415
Formula
C18 H24 N4 O4 S
MolWeight
392.478

Basic Information

Product Name: 2-(6-NITRO-1H-BENZOIMIDAZOL-2-YLSULFANYLMETHYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
English Synonyms: 2-(6-NITRO-1H-BENZOIMIDAZOL-2-YLSULFANYLMETHYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
MDL Number.: MFCD21099326
H bond acceptor: 8
H bond donor: 1
Smile: CC(C)(C)OC(=O)N1CCCCC1CSc2[nH]c3cc(ccc3n2)[N+](=O)[O-]
InChi: InChI=1S/C18H24N4O4S/c1-18(2,3)26-17(23)21-9-5-4-6-13(21)11-27-16-19-14-8-7-12(22(24)25)10-15(14)20-16/h7-8,10,13H,4-6,9,11H2,1-3H3,(H,19,20)
InChiKey: InChIKey=COQBFUDSSYOQCN-UHFFFAOYSA-N

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