Vitas-M small molecule compound
2-{[4-ethyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-nitrophenyl)acetamide
Catalog ID
STK400924
SMILES COc1ccccc1c1nnc(n1CC)SCC(=O)Nc1cccc(c1)[N+](=O)[O-]
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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 C19H19N5O4S MW 413.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N5O4S/c1-3-23-18(15-9-4-5-10-16(15)28-2)21-22-19(23)29-12-17(25)20-13-7-6-8-14(11-13)24(26)27/h4-11H,3,12H2,1-2H3,(H,20,25)InChIKey
ACOHJDJOEDMPTI-UHFFFAOYSA-NSynonyms
2((4ETHYL5(2METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N(3NITROPHENYL)ACETAMIDE
2((4ethyl5(2methoxyphenyl)4H124triazol3yl)sulfanyl)N(3nitrophenyl)acetamide
2(4ETHYL5(2METHOXYPHENYL)(124TRIAZOL3YLTHIO))N(3NITROPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)(N+)(=O)(O))C3=CC=CC=C3OC
COc1ccccc1c1nnc(n1CC)SCC(=O)Nc1cccc(c1)(N+)(=O)(O)
InChI=1SC19H19N5O4Sc132318(159451016(15)282)212219(23)291217(25)201376814(1113)24(26)27h411H312H212H3(H2025)
MFCD05539500
ZINC000003401452
ZINC03401452
ZINC3401452
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