Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)acetamide
Catalog ID
STL299141
SMILES C=CCn1c(SCC(=O)Nc2cc(OC)cc(c2)OC)nnc1c1ccc(cc1)C(C)(C)C
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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 C25H30N4O3S MW 466.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O3S/c1-7-12-29-23(17-8-10-18(11-9-17)25(2,3)4)27-28-24(29)33-16-22(30)26-19-13-20(31-5)15-21(14-19)32-6/h7-11,13-15H,1,12,16H2,2-6H3,(H,26,30)InChIKey
MCIQRPKEQBYPAU-UHFFFAOYSA-NSynonyms
862116-33-42((4allyl5(4(tertbutyl)phenyl)4H124triazol3yl)thio)N(35dimethoxyphenyl)acetamide
2((5(4tertbutylphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(35dimethoxyphenyl)acetamide
2((5(4TERTBUTYLPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(35DIMETHOXYPHENYL)ACETAMIDE
862116334
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)NC3=CC(=CC(=C3)OC)OC
InChI=1SC25H30N4O3Sc17122923(1781018(11917)25(23)4)272824(29)331622(30)26191320(315)1521(1419)326h7111315H11216H226H3(H2630)
MFCD05687050
N(35DIMETHOXYPHENYL)2(5(4(TERTBUTYL)PHENYL)4PROP2ENYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000009498302
ZINC09498302
ZINC9498302
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