Vitas-M small molecule compound
2-[(5-benzyl-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-nitrophenyl)acetamide
Catalog ID
STL376173
SMILES CCn1c(SCC(=O)Nc2cccc(c2)[N+](=O)[O-])nnc1Cc1ccccc1
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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 C19H19N5O3S MW 397.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N5O3S/c1-2-23-17(11-14-7-4-3-5-8-14)21-22-19(23)28-13-18(25)20-15-9-6-10-16(12-15)24(26)27/h3-10,12H,2,11,13H2,1H3,(H,20,25)InChIKey
PUNXKQPLJUVOSC-UHFFFAOYSA-NSynonyms
2((5BENZYL4ETHYL124TRIAZOL3YL)SULFANYL)N(3NITROPHENYL)ACETAMIDE
2((5benzyl4ethyl4H124triazol3yl)sulfanyl)N(3nitrophenyl)acetamide
CCN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)(N+)(=O)(O))CC3=CC=CC=C3
CCn1c(SCC(=O)Nc2cccc(c2)(N+)(=O)(O))nnc1Cc1ccccc1
InChI=1SC19H19N5O3Sc122317(11147435814)212219(23)281318(25)2015961016(1215)24(26)27h31012H21113H21H3(H2025)
MFCD04333735
ZINC000002849438
ZINC02849438
ZINC2849438
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