Vitas-M small molecule compound
2-[4-ethyl-5-({2-[(4-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]-N-(1,3-thiazol-2-yl)acetamide
Catalog ID
STK274040
SMILES CCn1c(SCC(=O)Nc2ccc(cc2)[N+](=O)[O-])nnc1CC(=O)Nc1nccs1
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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 C17H17N7O4S2 MW 447.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N7O4S2/c1-2-23-13(9-14(25)20-16-18-7-8-29-16)21-22-17(23)30-10-15(26)19-11-3-5-12(6-4-11)24(27)28/h3-8H,2,9-10H2,1H3,(H,19,26)(H,18,20,25)InChIKey
VAQZQWBZTRBHNA-UHFFFAOYSA-NSynonyms
2(4ETHYL5((2((4NITROPHENYL)AMINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)N(13THIAZOL2YL)ACETAMIDE
2(4ethyl5(2(4nitroanilino)2oxoethyl)sulfanyl124triazol3yl)N(13thiazol2yl)acetamide
CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)(N+)(=O)(O))CC(=O)NC3=NC=CS3
CCn1c(SCC(=O)Nc2ccc(cc2)(N+)(=O)(O))nnc1CC(=O)Nc1nccs1
InChI=1SC17H17N7O4S2c122313(914(25)201618782916)212217(23)301015(26)19113512(6411)24(27)28h38H2910H21H3(H1926)(H182025)
MFCD09268346
ZINC000009615139
ZINC09615139
ZINC9615139
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