Vitas-M small molecule compound

N-{2-[(ethylcarbamoyl)amino]ethyl}-4-methyl-3-nitrobenzenesulfonamide

Catalog ID
STK137641
SMILES CCNC(=O)NCCNS(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C12H18N4O5S MW 330.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18N4O5S/c1-3-13-12(17)14-6-7-15-22(20,21)10-5-4-9(2)11(8-10)16(18)19/h4-5,8,15H,3,6-7H2,1-2H3,(H2,13,14,17)
InChIKey
IXZRTRHBTLTWQK-UHFFFAOYSA-N
Synonyms

1ETHYL3(2((4METHYL3NITROPHENYL)SULFONYLAMINO)ETHYL)UREA
CCNC(=O)NCCNS(=O)(=O)C1=CC(=C(C=C1)C)(N+)(=O)(O)
CCNC(=O)NCCNS(=O)(=O)c1ccc(c(c1)(N+)(=O)(O))C
InChI=1SC12H18N4O5Sc131312(17)14671522(2021)10549(2)11(810)16(18)19h45815H367H212H3(H2131417)
MFCD01892264
N(2((ETHYLCARBAMOYL)AMINO)ETHYL)4METHYL3NITROBENZENESULFONAMIDE
ZINC000004681542
ZINC04681542
ZINC4681542

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.