Vitas-M small molecule compound
N-[(4-ethyl-5-{[2-(1-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]-1,3-benzodioxole-5-carboxamide
Catalog ID
STK297786
SMILES CCn1c(CNC(=O)c2ccc3c(c2)OCO3)nnc1SCC(=O)c1cn(c2c1cccc2)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 C24H23N5O4S MW 477.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N5O4S/c1-3-29-22(11-25-23(31)15-8-9-20-21(10-15)33-14-32-20)26-27-24(29)34-13-19(30)17-12-28(2)18-7-5-4-6-16(17)18/h4-10,12H,3,11,13-14H2,1-2H3,(H,25,31)InChIKey
IUTRBLYJSKBPNH-UHFFFAOYSA-NSynonyms
BENZO(13)DIOXOLE5CARBOXYLICACID(4ETHYL5(2(1METHYL1HINDOL3YL)2OXOETHYLSULFANYL)4H(124)TRIAZOL3YLMETHYL)AMIDE
CCN1C(=NN=C1SCC(=O)C2=CN(C3=CC=CC=C32)C)CNC(=O)C4=CC5=C(C=C4)OCO5
InChI=1SC24H23N5O4Sc132922(112523(31)15892021(1015)33143220)262724(29)341319(30)171228(2)18754616(17)18h41012H3111314H212H3(H2531)
MFCD09961180
N((4ethyl5((2(1methyl1Hindol3yl)2oxoethyl)sulfanyl)4H124triazol3yl)methyl)13benzodioxole5carboxamide
N((4ethyl5(2(1methylindol3yl)2oxoethyl)sulfanyl124triazol3yl)methyl)13benzodioxole5carboxamide
ZINC000013956747
ZINC13956747
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