Vitas-M small molecule compound
N-(2-chlorophenyl)-3-[4-methyl-5-({2-[(3-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]propanamide
Catalog ID
STK246191
SMILES O=C(Nc1cccc(c1)[N+](=O)[O-])CSc1nnc(n1C)CCC(=O)Nc1ccccc1Cl
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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 C20H19ClN6O4S MW 474.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN6O4S/c1-26-17(9-10-18(28)23-16-8-3-2-7-15(16)21)24-25-20(26)32-12-19(29)22-13-5-4-6-14(11-13)27(30)31/h2-8,11H,9-10,12H2,1H3,(H,22,29)(H,23,28)InChIKey
QKYYTKVAVOQXIM-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)(N+)(=O)(O))CCC(=O)NC3=CC=CC=C3Cl
InChI=1SC20H19ClN6O4Sc12617(91018(28)2316832715(16)21)242520(26)321219(29)221354614(1113)27(30)31h2811H91012H21H3(H2229)(H2328)
MFCD08683838
N(2chlorophenyl)3(4methyl5((2((3nitrophenyl)amino)2oxoethyl)sulfanyl)4H124triazol3yl)propanamide
N(2CHLOROPHENYL)3(4METHYL5((3NITROPHENYLCARBAMOYL)METHYLSULFANYL)4H(124)TRIAZOL3YL)PROPIONAMIDE
N(2chlorophenyl)3(4methyl5(2(3nitroanilino)2oxoethyl)sulfanyl124triazol3yl)propanamide
O=C(Nc1cccc(c1)(N+)(=O)(O))CSc1nnc(n1C)CCC(=O)Nc1ccccc1Cl
ZINC000009328989
ZINC09328989
ZINC9328989
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