Vitas-M small molecule compound
2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)acetamide
Catalog ID
STL057196
SMILES C=CCn1c(SCC(=O)Nc2cc(OC)cc(c2)OC)nnc1c1cccc(c1)Cl
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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 C21H21ClN4O3S MW 444.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN4O3S/c1-4-8-26-20(14-6-5-7-15(22)9-14)24-25-21(26)30-13-19(27)23-16-10-17(28-2)12-18(11-16)29-3/h4-7,9-12H,1,8,13H2,2-3H3,(H,23,27)InChIKey
IVJVWABYAIJOOV-UHFFFAOYSA-NSynonyms
861639-75-02((4allyl5(3chlorophenyl)4H124triazol3yl)thio)N(35dimethoxyphenyl)acetamide
2((5(3chlorophenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(35dimethoxyphenyl)acetamide
2((5(3CHLOROPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(35DIMETHOXYPHENYL)ACETAMIDE
861639750
COC1=CC(=CC(=C1)NC(=O)CSC2=NN=C(N2CC=C)C3=CC(=CC=C3)Cl)OC
InChI=1SC21H21ClN4O3Sc1482620(1465715(22)914)242521(26)301319(27)23161017(282)1218(1116)293h47912H1813H223H3(H2327)
MFCD05685793
N(35DIMETHOXYPHENYL)2(5(3CHLOROPHENYL)4PROP2ENYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000009480033
ZINC09480033
ZINC9480033
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