Vitas-M small molecule compound
2-{[4-methyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-nitrophenyl)ethanone
Catalog ID
STK804151
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])CSc1nnc(n1C)c1cccs1
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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 C15H12N4O3S2 MW 360.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12N4O3S2/c1-18-14(13-3-2-8-23-13)16-17-15(18)24-9-12(20)10-4-6-11(7-5-10)19(21)22/h2-8H,9H2,1H3InChIKey
YPAPHTJHIREKPH-UHFFFAOYSA-NSynonyms
2((4methyl5(thiophen2yl)4H124triazol3yl)sulfanyl)1(4nitrophenyl)ethanone
2((4METHYL5THIOPHEN2YL124TRIAZOL3YL)SULFANYL)1(4NITROPHENYL)ETHANONE
2(4METHYL5(2THIENYL)(124TRIAZOL3YLTHIO))1(4NITROPHENYL)ETHAN1ONE
CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)(N+)(=O)(O))C3=CC=CS3
InChI=1SC15H12N4O3S2c11814(133282313)161715(18)24912(20)104611(7510)19(21)22h28H9H21H3
MFCD04426912
O=C(c1ccc(cc1)(N+)(=O)(O))CSc1nnc(n1C)c1cccs1
ZINC000001058022
ZINC01058022
ZINC1058022
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