Vitas-M small molecule compound
2-{[5-ethyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methyl-4-nitrophenyl)acetamide
Catalog ID
STK245902
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2C)[N+](=O)[O-])nnc1CC
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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 C16H19N5O3S MW 361.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N5O3S/c1-4-8-20-14(5-2)18-19-16(20)25-10-15(22)17-13-7-6-12(21(23)24)9-11(13)3/h4,6-7,9H,1,5,8,10H2,2-3H3,(H,17,22)InChIKey
RGZKLYVEFKLQIH-UHFFFAOYSA-NSynonyms
2((5ETHYL4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)N(2METHYL4NITROPHENYL)ACETAMIDE
2((5ethyl4prop2enyl124triazol3yl)sulfanyl)N(2methyl4nitrophenyl)acetamide
2(4ALLYL5ETHYL4H(124)TRIAZOL3YLSULFANYL)N(2METHYL4NITROPHENYL)ACETAMIDE
C=CCn1c(SCC(=O)Nc2ccc(cc2C)(N+)(=O)(O))nnc1CC
CCC1=NN=C(N1CC=C)SCC(=O)NC2=C(C=C(C=C2)(N+)(=O)(O))C
InChI=1SC16H19N5O3Sc1482014(52)181916(20)251015(22)17137612(21(23)24)911(13)3h4679H15810H223H3(H1722)
MFCD08670687
ZINC000009328416
ZINC09328416
ZINC9328416
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