Vitas-M small molecule compound
3-chloro-N-({3-methoxy-4-[(2-methylpropanoyl)amino]phenyl}carbamothioyl)-1-benzothiophene-2-carboxamide
Catalog ID
STK234464
SMILES COc1cc(ccc1NC(=O)C(C)C)NC(=S)NC(=O)c1sc2c(c1Cl)cccc2
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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 C21H20ClN3O3S2 MW 461.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN3O3S2/c1-11(2)19(26)24-14-9-8-12(10-15(14)28-3)23-21(29)25-20(27)18-17(22)13-6-4-5-7-16(13)30-18/h4-11H,1-3H3,(H,24,26)(H2,23,25,27,29)InChIKey
KPAQNJHJZPXYEK-UHFFFAOYSA-NSynonyms
3chloroN((3methoxy4((2methylpropanoyl)amino)phenyl)carbamothioyl)1benzothiophene2carboxamide
3CHLORON((3METHOXY4(2METHYLPROPANOYLAMINO)PHENYL)CARBAMOTHIOYL)1BENZOTHIOPHENE2CARBOXAMIDE
CC(C)C(=O)NC1=C(C=C(C=C1)NC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)OC
InChI=1SC21H20ClN3O3S2c111(2)19(26)24149812(1015(14)283)2321(29)2520(27)1817(22)13645716(13)3018h411H13H3(H2426)(H223252729)
MFCD03909297
ZINC000002840649
ZINC02840649
ZINC2840649
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