Vitas-M small molecule compound
2-[5-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]-N-(3,4-dimethylphenyl)acetamide
Catalog ID
STK221717
SMILES C=CCn1c(nnc1SCC(=O)N1CCc2c1cccc2)CC(=O)Nc1ccc(c(c1)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 C25H27N5O2S MW 461.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N5O2S/c1-4-12-30-22(15-23(31)26-20-10-9-17(2)18(3)14-20)27-28-25(30)33-16-24(32)29-13-11-19-7-5-6-8-21(19)29/h4-10,14H,1,11-13,15-16H2,2-3H3,(H,26,31)InChIKey
OYRQHNIVAUTNEQ-UHFFFAOYSA-NSynonyms
2(4ALLYL5(2(23DIHYDROINDOL1YL)2OXOETHYLSULFANYL)4H(124)TRIAZOL3YL)N(34DIMETHYLPHENYL)ACETAMIDE
2(5((2(23DIHYDRO1HINDOL1YL)2OXOETHYL)SULFANYL)4(PROP2EN1YL)4H124TRIAZOL3YL)N(34DIMETHYLPHENYL)ACETAMIDE
2(5(2(23DIHYDROINDOL1YL)2OXOETHYL)SULFANYL4PROP2ENYL124TRIAZOL3YL)N(34DIMETHYLPHENYL)ACETAMIDE
CC1=C(C=C(C=C1)NC(=O)CC2=NN=C(N2CC=C)SCC(=O)N3CCC4=CC=CC=C43)C
InChI=1SC25H27N5O2Sc14123022(1523(31)262010917(2)18(3)1420)272825(30)331624(32)29131119756821(19)29h41014H111131516H223H3(H2631)
MFCD07399436
ZINC000009263719
ZINC09263719
ZINC9263719
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