Vitas-M small molecule compound
N-benzyl-2-{[5-(5-chloro-1-benzofuran-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK211526
SMILES C=CCn1c(SCC(=O)NCc2ccccc2)nnc1c1cc2c(o1)ccc(c2)Cl
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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 C22H19ClN4O2S MW 438.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN4O2S/c1-2-10-27-21(19-12-16-11-17(23)8-9-18(16)29-19)25-26-22(27)30-14-20(28)24-13-15-6-4-3-5-7-15/h2-9,11-12H,1,10,13-14H2,(H,24,28)InChIKey
IKBFOYQRRJOBSB-UHFFFAOYSA-NSynonyms
2(4ALLYL5(5CHLOROBENZOFURAN2YL)4H(124)TRIAZOL3YLSULFANYL)NBENZYLACETAMIDE
C=CCN1C(=NN=C1SCC(=O)NCC2=CC=CC=C2)C3=CC4=C(O3)C=CC(=C4)Cl
InChI=1SC22H19ClN4O2Sc12102721(1912161117(23)8918(16)2919)252622(27)301420(28)2413156435715h291112H1101314H2(H2428)
MFCD08670024
NBENZYL2((5(5CHLORO1BENZOFURAN2YL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
NBENZYL2((5(5CHLORO1BENZOFURAN2YL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000009261480
ZINC09261480
ZINC9261480
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