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-(2,6-dimethylphenyl)acetamide
Catalog ID
STL299173
SMILES C=CCn1c(SCC(=O)Nc2c(C)cccc2C)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 C25H30N4OS MW 434.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4OS/c1-7-15-29-23(19-11-13-20(14-12-19)25(4,5)6)27-28-24(29)31-16-21(30)26-22-17(2)9-8-10-18(22)3/h7-14H,1,15-16H2,2-6H3,(H,26,30)InChIKey
XLKNKNPXJSMQGZ-UHFFFAOYSA-NSynonyms
861639-62-52((4allyl5(4(tertbutyl)phenyl)4H124triazol3yl)thio)N(26dimethylphenyl)acetamide
2((5(4tertbutylphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(26dimethylphenyl)acetamide
2((5(4TERTBUTYLPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(26DIMETHYLPHENYL)ACETAMIDE
2(5(4(TERTBUTYL)PHENYL)4PROP2ENYL(124TRIAZOL3YLTHIO))N(26DIMETHYLPHENYL)ACETAMIDE
861639625
CC1=C(C(=CC=C1)C)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=C(C=C3)C(C)(C)C
InChI=1SC25H30N4OSc17152923(19111320(141219)25(45)6)272824(29)311621(30)262217(2)981018(22)3h714H11516H226H3(H2630)
MFCD05685777
ZINC000013804958
ZINC13804958
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