Vitas-M small molecule compound

N-ethyl-2-[2-(4-nitrophenoxy)propanoyl]hydrazinecarbothioamide

Catalog ID
STK435977
SMILES CCNC(=S)NNC(=O)C(Oc1ccc(cc1)[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 C12H16N4O4S MW 312.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16N4O4S/c1-3-13-12(21)15-14-11(17)8(2)20-10-6-4-9(5-7-10)16(18)19/h4-8H,3H2,1-2H3,(H,14,17)(H2,13,15,21)
InChIKey
DYRGKCGTIILQQH-UHFFFAOYSA-N
Synonyms

1ETHYL3(2(4NITROPHENOXY)PROPANOYLAMINO)THIOUREA
CCNC(=S)NNC(=O)C(C)OC1=CC=C(C=C1)(N+)(=O)(O)
CCNC(=S)NNC(=O)C(Oc1ccc(cc1)(N+)(=O)(O))C
InChI=1SC12H16N4O4Sc131312(21)151411(17)8(2)2010649(5710)16(18)19h48H3H212H3(H1417)(H2131521)
MFCD03944344
N(((ETHYLAMINO)THIOXOMETHYL)AMINO)2(4NITROPHENOXY)PROPANAMIDE
Nethyl2(2(4nitrophenoxy)propanoyl)hydrazinecarbothioamide
ZINC000006655146
ZINC000006655161

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Available files

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