Vitas-M small molecule compound
N-[5-(2-chlorobenzyl)-1,3-thiazol-2-yl]-2-{[4-(prop-2-en-1-yl)-5-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL481874
SMILES C=CCn1c(SCC(=O)Nc2ncc(s2)Cc2ccccc2Cl)nnc1c1csc2c1CCCC2
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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 C25H24ClN5OS3 MW 542.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN5OS3/c1-2-11-31-23(19-14-33-21-10-6-4-8-18(19)21)29-30-25(31)34-15-22(32)28-24-27-13-17(35-24)12-16-7-3-5-9-20(16)26/h2-3,5,7,9,13-14H,1,4,6,8,10-12,15H2,(H,27,28,32)InChIKey
FJLPSICIAJOOLA-UHFFFAOYSA-NSynonyms
C=CCN1C(=NN=C1SCC(=O)NC2=NC=C(S2)CC3=CC=CC=C3Cl)C4=CSC5=C4CCCC5
InChI=1SC25H24ClN5OS3c12113123(191433211064818(19)21)293025(31)341522(32)2824271317(3524)1216735920(16)26h235791314H1468101215H2(H272832)
MFCD05847603
N(5((2chlorophenyl)methyl)13thiazol2yl)2((4prop2enyl5(4567tetrahydro1benzothiophen3yl)124triazol3yl)sulfanyl)acetamide
N(5(2chlorobenzyl)13thiazol2yl)2((4(prop2en1yl)5(4567tetrahydro1benzothiophen3yl)4H124triazol3yl)sulfanyl)acetamide
ZINC000003764232
ZINC3764232
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