Vitas-M small molecule compound

2-{[4-(prop-2-en-1-yl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK475269
SMILES C=CCn1c(SCC(=O)N)nnc1c1ccccn1

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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 C12H13N5OS MW 275.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N5OS/c1-2-7-17-11(9-5-3-4-6-14-9)15-16-12(17)19-8-10(13)18/h2-6H,1,7-8H2,(H2,13,18)
InChIKey
MIUCGWXNXQBZOG-UHFFFAOYSA-N
Synonyms
573695-20-2
2((4(prop2en1yl)5(pyridin2yl)4H124triazol3yl)sulfanyl)acetamide
2((4allyl5(pyridin2yl)4H124triazol3yl)thio)acetamide
2((4PROP2ENYL5PYRIDIN2YL124TRIAZOL3YL)SULFANYL)ACETAMIDE
2(4PROP2ENYL5(2PYRIDYL)124TRIAZOL3YLTHIO)ACETAMIDE
573695202
C=CCN1C(=NN=C1SCC(=O)N)C2=CC=CC=N2
InChI=1SC12H13N5OSc1271711(95346149)151612(17)19810(13)18h26H178H2(H21318)
MFCD04017619
ZINC000000528384
ZINC00528384
ZINC528384

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.