Vitas-M small molecule compound
N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(6-amino-3,5-dicyanopyridin-2-yl)sulfanyl]acetamide
Catalog ID
STK507016
SMILES N#Cc1cc(C#N)c(nc1SCC(=O)Nc1cc2OCOc2cc1C(=O)C)N
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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 C18H13N5O4S MW 395.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N5O4S/c1-9(24)12-3-14-15(27-8-26-14)4-13(12)22-16(25)7-28-18-11(6-20)2-10(5-19)17(21)23-18/h2-4H,7-8H2,1H3,(H2,21,23)(H,22,25)InChIKey
NLFWASKMRRDJPA-UHFFFAOYSA-NSynonyms
CC(=O)C1=CC2=C(C=C1NC(=O)CSC3=C(C=C(C(=N3)N)C#N)C#N)OCO2
InChI=1SC18H13N5O4Sc19(24)1231415(2782614)413(12)2216(25)7281811(620)210(519)17(21)2318h24H78H21H3(H22123)(H2225)
MFCD13369064
N(6acetyl13benzodioxol5yl)2((6amino35dicyanopyridin2yl)sulfanyl)acetamide
N(6acetyl13benzodioxol5yl)2(6amino35dicyanopyridin2yl)sulfanylacetamide
ZINC000035655339
ZINC35655339
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