Vitas-M small molecule compound

1-(2-methoxy-4-nitrophenyl)-3-morpholin-4-ylthiourea

Catalog ID
STK455566
SMILES COc1cc(ccc1NC(=S)NN1CCOCC1)[N+](=O)[O-]

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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/c1-19-11-8-9(16(17)18)2-3-10(11)13-12(21)14-15-4-6-20-7-5-15/h2-3,8H,4-7H2,1H3,(H2,13,14,21)
InChIKey
TUEASDMFPYLBFF-UHFFFAOYSA-N
Synonyms

((2METHOXY4NITROPHENYL)AMINO)(MORPHOLIN4YLAMINO)METHANE1THIONE
1(2methoxy4nitrophenyl)3morpholin4ylthiourea
COC1=C(C=CC(=C1)(N+)(=O)(O))NC(=S)NN2CCOCC2
COc1cc(ccc1NC(=S)NN1CCOCC1)(N+)(=O)(O)
InChI=1SC12H16N4O4Sc1191189(16(17)18)2310(11)1312(21)141546207515h238H47H21H3(H2131421)
MFCD04227504
ZINC000005041250
ZINC05041250
ZINC5041250

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Available files

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