Vitas-M small molecule compound
N-(4-ethylphenyl)-2-{[4-(2-phenylethyl)-5-(3,4,5-triethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL070007
SMILES CCOc1cc(cc(c1OCC)OCC)c1nnc(n1CCc1ccccc1)SCC(=O)Nc1ccc(cc1)CC
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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 C32H38N4O4S MW 574.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H38N4O4S/c1-5-23-14-16-26(17-15-23)33-29(37)22-41-32-35-34-31(36(32)19-18-24-12-10-9-11-13-24)25-20-27(38-6-2)30(40-8-4)28(21-25)39-7-3/h9-17,20-21H,5-8,18-19,22H2,1-4H3,(H,33,37)InChIKey
ZCTHGEIMQUQVOX-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CCC3=CC=CC=C3)C4=CC(=C(C(=C4)OCC)OCC)OCC
InChI=1SC32H38N4O4Sc1523141626(171523)3329(37)224132353431(36(32)19182412109111324)252027(3862)30(4084)28(2125)3973h9172021H58181922H214H3(H3337)
MFCD03613094
N(4ethylphenyl)2((4(2phenylethyl)5(345triethoxyphenyl)124triazol3yl)sulfanyl)acetamide
N(4ethylphenyl)2((4(2phenylethyl)5(345triethoxyphenyl)4H124triazol3yl)sulfanyl)acetamide
N(4ETHYLPHENYL)2((4PHENETHYL5(345TRIETHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4ethylphenyl)2((4phenethyl5(345triethoxyphenyl)4H124triazol3yl)thio)acetamide
ZINC000102965587
ZINC102965587
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