Vitas-M small molecule compound
N-(2-chloro-5-nitrophenyl)-2-{[4-methyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK249170
SMILES O=C(Nc1cc(ccc1Cl)[N+](=O)[O-])CSc1nnc(n1C)c1ccncc1
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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 C16H13ClN6O3S MW 404.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN6O3S/c1-22-15(10-4-6-18-7-5-10)20-21-16(22)27-9-14(24)19-13-8-11(23(25)26)2-3-12(13)17/h2-8H,9H2,1H3,(H,19,24)InChIKey
VMTHMOBONQKZAY-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)(N+)(=O)(O))Cl)C3=CC=NC=C3
InChI=1SC16H13ClN6O3Sc12215(1046187510)202116(22)27914(24)1913811(23(25)26)2312(13)17h28H9H21H3(H1924)
MFCD07437406
N(2chloro5nitrophenyl)2((4methyl5(pyridin4yl)4H124triazol3yl)sulfanyl)acetamide
N(2CHLORO5NITROPHENYL)2((4METHYL5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)ACETAMIDE
O=C(Nc1cc(ccc1Cl)(N+)(=O)(O))CSc1nnc(n1C)c1ccncc1
ZINC000003578137
ZINC03578137
ZINC3578137
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