Vitas-M small molecule compound
3-chloro-N-{[4-hydroxy-1-(methylsulfanyl)-4-(prop-2-en-1-yl)hept-6-en-3-yl]carbamothioyl}-1-benzothiophene-2-carboxamide
Catalog ID
STK324203
SMILES CSCCC(C(CC=C)(CC=C)O)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 C21H25ClN2O2S3 MW 469.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25ClN2O2S3/c1-4-11-21(26,12-5-2)16(10-13-28-3)23-20(27)24-19(25)18-17(22)14-8-6-7-9-15(14)29-18/h4-9,16,26H,1-2,10-13H2,3H3,(H2,23,24,25,27)InChIKey
NILQAGJVVHZKTH-UHFFFAOYSA-NSynonyms
817564-35-53chloroN((4hydroxy1(methylsulfanyl)4(prop2en1yl)hept6en3yl)carbamothioyl)1benzothiophene2carboxamide
3CHLORON((4HYDROXY1METHYLSULFANYL4PROP2ENYLHEPT6EN3YL)CARBAMOTHIOYL)1BENZOTHIOPHENE2CARBOXAMIDE
817564355
CSCCC(C(CC=C)(CC=C)O)NC(=S)NC(=O)C1=C(C2=CC=CC=C2S1)Cl
InChI=1SC21H25ClN2O2S3c141121(261252)16(1013283)2320(27)2419(25)1817(22)14867915(14)2918h491626H121013H23H3(H223242527)
MFCD05053996
N(2ALLYL2HYDROXY1(2(METHYLSULFANYL)ETHYL)4PENTENYL)N((3CHLORO1BENZOTHIEN2YL)CARBONYL)THIOUREA
ZINC000008722780
ZINC000008722781
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