Vitas-M small molecule compound
2-({5-[4-(cyclopentyloxy)phenyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-nitrophenyl)acetamide
Catalog ID
STK469964
SMILES O=C(Nc1ccccc1[N+](=O)[O-])CSc1nnc(n1C)c1ccc(cc1)OC1CCCC1
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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 C22H23N5O4S MW 453.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O4S/c1-26-21(15-10-12-17(13-11-15)31-16-6-2-3-7-16)24-25-22(26)32-14-20(28)23-18-8-4-5-9-19(18)27(29)30/h4-5,8-13,16H,2-3,6-7,14H2,1H3,(H,23,28)InChIKey
ZUDFQOXKZCECTD-UHFFFAOYSA-NSynonyms
2((5(4(cyclopentyloxy)phenyl)4methyl4H124triazol3yl)sulfanyl)N(2nitrophenyl)acetamide
2((5(4cyclopentyloxyphenyl)4methyl124triazol3yl)sulfanyl)N(2nitrophenyl)acetamide
2(5(4CYCLOPENTYLOXYPHENYL)4METHYL(124TRIAZOL3YLTHIO))N(2NITROPHENYL)ACETAMIDE
CN1C(=NN=C1SCC(=O)NC2=CC=CC=C2(N+)(=O)(O))C3=CC=C(C=C3)OC4CCCC4
InChI=1SC22H23N5O4Sc12621(15101217(131115)3116623716)242522(26)321420(28)2318845919(18)27(29)30h4581316H236714H21H3(H2328)
MFCD07064854
O=C(Nc1ccccc1(N+)(=O)(O))CSc1nnc(n1C)c1ccc(cc1)OC1CCCC1
ZINC000020427742
ZINC20427742
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