Vitas-M small molecule compound
2-[({[4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STL294374
SMILES CCn1c(SCC(=O)Nc2sc3c(c2C(=O)N)CCCC3)nnc1c1ccncc1
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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 C20H22N6O2S2 MW 442.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N6O2S2/c1-2-26-18(12-7-9-22-10-8-12)24-25-20(26)29-11-15(27)23-19-16(17(21)28)13-5-3-4-6-14(13)30-19/h7-10H,2-6,11H2,1H3,(H2,21,28)(H,23,27)InChIKey
DARVWRLUNUUZPQ-UHFFFAOYSA-NSynonyms
2((((4ethyl5(pyridin4yl)4H124triazol3yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxamide
2((2((4ethyl5pyridin4yl124triazol3yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxamide
CCN1C(=NN=C1SCC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N)C4=CC=NC=C4
InChI=1SC20H22N6O2S2c122618(12792210812)242520(26)291115(27)231916(17(21)28)13534614(13)3019h710H2611H21H3(H22128)(H2327)
MFCD03733903
ZINC000006878324
ZINC06878324
ZINC6878324
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