Vitas-M small molecule compound

N-(3-methoxyphenyl)-2-(4-methyl-5-{[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)acetamide

Catalog ID
STK245578
SMILES COc1cccc(c1)NC(=O)Cc1nnc(n1C)SCC(=O)c1cccc(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 C20H19N5O5S MW 441.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O5S/c1-24-18(11-19(27)21-14-6-4-8-16(10-14)30-2)22-23-20(24)31-12-17(26)13-5-3-7-15(9-13)25(28)29/h3-10H,11-12H2,1-2H3,(H,21,27)
InChIKey
PTKOLXKZAUWEOZ-UHFFFAOYSA-N
Synonyms

CN1C(=NN=C1SCC(=O)C2=CC(=CC=C2)(N+)(=O)(O))CC(=O)NC3=CC(=CC=C3)OC
COc1cccc(c1)NC(=O)Cc1nnc(n1C)SCC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC20H19N5O5Sc12418(1119(27)211464816(1014)302)222320(24)311217(26)1353715(913)25(28)29h310H1112H212H3(H2127)
MFCD08670190
N(3METHOXYPHENYL)2(4METHYL5((2(3NITROPHENYL)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)ACETAMIDE
N(3METHOXYPHENYL)2(4METHYL5(2(3NITROPHENYL)2OXOETHYL)SULFANYL124TRIAZOL3YL)ACETAMIDE
N(3METHOXYPHENYL)2(4METHYL5(2(3NITROPHENYL)2OXOETHYLSULFANYL)4H(124)TRIAZOL3YL)ACETAMIDE
ZINC000009327541
ZINC09327541
ZINC9327541

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Available files

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