Vitas-M small molecule compound

1-cyclopentyl-3-(4-nitrophenyl)thiourea

Catalog ID
STK018843
SMILES S=C(Nc1ccc(cc1)[N+](=O)[O-])NC1CCCC1

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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 C12H15N3O2S MW 265.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N3O2S/c16-15(17)11-7-5-10(6-8-11)14-12(18)13-9-3-1-2-4-9/h5-9H,1-4H2,(H2,13,14,18)
InChIKey
PYVNTQSLPNHUKM-UHFFFAOYSA-N
Synonyms
405068-27-1
(CYCLOPENTYLAMINO)((4NITROPHENYL)AMINO)METHANE1THIONE
1CYCLOPENTYL3(4NITROPHENYL)THIOUREA
405068271
C1CCC(C1)NC(=S)NC2=CC=C(C=C2)(N+)(=O)(O)
InChI=1SC12H15N3O2Sc1615(17)117510(6811)1412(18)13931249h59H14H2(H2131418)
MFCD02242992
S=C(Nc1ccc(cc1)(N+)(=O)(O))NC1CCCC1
STK018843
ZINC000004561204
ZINC04561204
ZINC4561204

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Available files

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