Vitas-M small molecule compound

2-methoxy-N-({2-[(4-nitrophenyl)carbonyl]hydrazinyl}carbonothioyl)benzamide

Catalog ID
STL063021
SMILES COc1ccccc1C(=O)NC(=S)NNC(=O)c1ccc(cc1)[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 C16H14N4O5S MW 374.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O5S/c1-25-13-5-3-2-4-12(13)15(22)17-16(26)19-18-14(21)10-6-8-11(9-7-10)20(23)24/h2-9H,1H3,(H,18,21)(H2,17,19,22,26)
InChIKey
IMSFIYLTPODINK-UHFFFAOYSA-N
Synonyms

2METHOXYN(((4NITROBENZOYL)AMINO)CARBAMOTHIOYL)BENZAMIDE
2methoxyN((2((4nitrophenyl)carbonyl)hydrazinyl)carbonothioyl)benzamide
2METHOXYN((2(4NITROBENZOYL)HYDRAZINO)CARBONOTHIOYL)BENZAMIDE
COC1=CC=CC=C1C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)(N+)(=O)(O)
COc1ccccc1C(=O)NC(=S)NNC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC16H14N4O5Sc12513532412(13)15(22)1716(26)191814(21)106811(9710)20(23)24h29H1H3(H1821)(H217192226)
MFCD03904625
ZINC000002859663
ZINC02859663
ZINC2859663

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Available files

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