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-chloro-4,6-dimethylphenyl)acetamide
Catalog ID
STL299171
SMILES C=CCn1c(SCC(=O)Nc2c(C)cc(cc2Cl)C)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 C25H29ClN4OS MW 469.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29ClN4OS/c1-7-12-30-23(18-8-10-19(11-9-18)25(4,5)6)28-29-24(30)32-15-21(31)27-22-17(3)13-16(2)14-20(22)26/h7-11,13-14H,1,12,15H2,2-6H3,(H,27,31)InChIKey
XATXHJCZPNONSR-UHFFFAOYSA-NSynonyms
808185-12-82((4allyl5(4(tertbutyl)phenyl)4H124triazol3yl)thio)N(2chloro46dimethylphenyl)acetamide
2((5(4tertbutylphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(2chloro46dimethylphenyl)acetamide
2((5(4TERTBUTYLPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(2CHLORO46DIMETHYLPHENYL)ACETAMIDE
2(5(4(TERTBUTYL)PHENYL)4PROP2ENYL(124TRIAZOL3YLTHIO))N(2CHLORO46DIMETHYLPHENYL)ACETAMIDE
808185128
CC1=CC(=C(C(=C1)Cl)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=C(C=C3)C(C)(C)C)C
InChI=1SC25H29ClN4OSc17123023(1881019(11918)25(45)6)282924(30)321521(31)272217(3)1316(2)1420(22)26h7111314H11215H226H3(H2731)
MFCD05680443
ZINC000002450924
ZINC02450924
ZINC2450924
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