Vitas-M small molecule compound
{[5-benzyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
Catalog ID
STL182637
SMILES C=CCn1c(SCC(=O)O)nnc1Cc1ccccc1
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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 C14H15N3O2S MW 289.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N3O2S/c1-2-8-17-12(9-11-6-4-3-5-7-11)15-16-14(17)20-10-13(18)19/h2-7H,1,8-10H2,(H,18,19)InChIKey
OBWWSGFXMKEOHL-UHFFFAOYSA-NSynonyms
56929-54-5((5benzyl4(prop2en1yl)4H124triazol3yl)sulfanyl)aceticacid
(4ALLYL5BENZYL4H(124)TRIAZOL3YLSULFANYL)ACETICACID
2((5BENZYL4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETICACID
2((5BENZYL4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETICACID
2(5BENZYL4PROP2ENYL124TRIAZOL3YLTHIO)ACETICACID
56929545
C=CCN1C(=NN=C1SCC(=O)O)CC2=CC=CC=C2
InChI=1SC14H15N3O2Sc1281712(9116435711)151614(17)201013(18)19h27H1810H2(H1819)
MFCD02671609
ZINC000005495037
ZINC5495037
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