Vitas-M small molecule compound
1-[2-(cyclohex-1-en-1-yl)ethyl]-3-(2-methoxy-4-nitrophenyl)thiourea
Catalog ID
STK455398
SMILES COc1cc(ccc1NC(=S)NCCC1=CCCCC1)[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 C16H21N3O3S MW 335.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3O3S/c1-22-15-11-13(19(20)21)7-8-14(15)18-16(23)17-10-9-12-5-3-2-4-6-12/h5,7-8,11H,2-4,6,9-10H2,1H3,(H2,17,18,23)InChIKey
RWNRVXSQKKEJLD-UHFFFAOYSA-NSynonyms
((2CYCLOHEX1ENYLETHYL)AMINO)((2METHOXY4NITROPHENYL)AMINO)METHANE1THIONE
1(2(cyclohex1en1yl)ethyl)3(2methoxy4nitrophenyl)thiourea
1(2(CYCLOHEXEN1YL)ETHYL)3(2METHOXY4NITROPHENYL)THIOUREA
COC1=C(C=CC(=C1)(N+)(=O)(O))NC(=S)NCCC2=CCCCC2
COc1cc(ccc1NC(=S)NCCC1=CCCCC1)(N+)(=O)(O)
InChI=1SC16H21N3O3Sc122151113(19(20)21)7814(15)1816(23)17109125324612h57811H246910H21H3(H2171823)
MFCD04228470
ZINC000004999154
ZINC04999154
ZINC4999154
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