Vitas-M small molecule compound

4-methoxy-N-{[3-methoxy-4-(pentanoylamino)phenyl]carbamothioyl}-3-nitrobenzamide

Catalog ID
STK234112
SMILES CCCCC(=O)Nc1ccc(cc1OC)NC(=S)NC(=O)c1ccc(c(c1)[N+](=O)[O-])OC

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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 C21H24N4O6S MW 460.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O6S/c1-4-5-6-19(26)23-15-9-8-14(12-18(15)31-3)22-21(32)24-20(27)13-7-10-17(30-2)16(11-13)25(28)29/h7-12H,4-6H2,1-3H3,(H,23,26)(H2,22,24,27,32)
InChIKey
NWSVVRLYNISASO-UHFFFAOYSA-N
Synonyms

4methoxyN((3methoxy4(pentanoylamino)phenyl)carbamothioyl)3nitrobenzamide
CCCCC(=O)NC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)(N+)(=O)(O))OC
CCCCC(=O)Nc1ccc(cc1OC)NC(=S)NC(=O)c1ccc(c(c1)(N+)(=O)(O))OC
InChI=1SC21H24N4O6Sc145619(26)23159814(1218(15)313)2221(32)2420(27)1371017(302)16(1113)25(28)29h712H46H213H3(H2326)(H222242732)
MFCD03561700
ZINC000009291154
ZINC09291154
ZINC9291154

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Available files

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