Vitas-M small molecule compound
1-(1-methyl-1H-indol-3-yl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)ethanone
Catalog ID
STK804286
SMILES O=C(c1cn(c2c1cccc2)C)CSc1nnc[nH]1
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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 C13H12N4OS MW 272.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N4OS/c1-17-6-10(9-4-2-3-5-11(9)17)12(18)7-19-13-14-8-15-16-13/h2-6,8H,7H2,1H3,(H,14,15,16)InChIKey
BCWWMMYHPPBEMV-UHFFFAOYSA-NSynonyms
929972-92-91(1methyl1Hindol3yl)2(4H124triazol3ylsulfanyl)ethanone
1(1methylindol3yl)2(1H124triazol5ylsulfanyl)ethanone
2((4H124triazol3yl)thio)1(1methyl1Hindol3yl)ethanone
929972929
CN1C=C(C2=CC=CC=C21)C(=O)CSC3=NC=NN3
InChI=1SC13H12N4OSc117610(9423511(9)17)12(18)71913148151613h268H7H21H3(H141516)
MFCD09216608
O=C(c1cn(c2c1cccc2)C)CSc1nnc(nH)1
ZINC000008993540
ZINC08993540
ZINC8993540
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