Vitas-M small molecule compound
N-[(5-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)methyl]-1,3-benzodioxole-5-carboxamide
Catalog ID
STK232328
SMILES O=C(c1ccc2c(c1)OCO2)NCc1nnc(n1C)SCC(=O)N1CCc2c1cccc2
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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 C22H21N5O4S MW 451.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5O4S/c1-26-19(11-23-21(29)15-6-7-17-18(10-15)31-13-30-17)24-25-22(26)32-12-20(28)27-9-8-14-4-2-3-5-16(14)27/h2-7,10H,8-9,11-13H2,1H3,(H,23,29)InChIKey
ONTXORPAFHICLS-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCC(=O)N2CCC3=CC=CC=C32)CNC(=O)C4=CC5=C(C=C4)OCO5
InChI=1SC22H21N5O4Sc12619(112321(29)15671718(1015)31133017)242522(26)321220(28)279814423516(14)27h2710H891113H21H3(H2329)
MFCD07792031
N((5((2(23DIHYDRO1HINDOL1YL)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)13BENZODIOXOLE5CARBOXAMIDE
N((5(2(23DIHYDROINDOL1YL)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)METHYL)13BENZODIOXOLE5CARBOXAMIDE
ZINC000009263801
ZINC09263801
ZINC9263801
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