Vitas-M small molecule compound
ethyl 4-methyl-2-[({[5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetyl)amino]-1,3-thiazole-5-carboxylate
Catalog ID
STK125077
SMILES CCOC(=O)c1sc(nc1C)NC(=O)CSc1nnc2c(n1)n(CC=C)c1c2cccc1
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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 C21H20N6O3S2 MW 468.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6O3S2/c1-4-10-27-14-9-7-6-8-13(14)16-18(27)24-21(26-25-16)31-11-15(28)23-20-22-12(3)17(32-20)19(29)30-5-2/h4,6-9H,1,5,10-11H2,2-3H3,(H,22,23,28)InChIKey
OGCLAPYVTBPMOS-UHFFFAOYSA-NSynonyms
431055-24-2431055242
CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NC3=C(C4=CC=CC=C4N3CC=C)N=N2)C
ETHYL4METHYL2((((5(PROP2EN1YL)5H(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETYL)AMINO)13THIAZOLE5CARBOXYLATE
ETHYL4METHYL2((2((5PROP2ENYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETYL)AMINO)13THIAZOLE5CARBOXYLATE
InChI=1SC21H20N6O3S2c14102714976813(14)1618(27)2421(262516)311115(28)23202212(3)17(3220)19(29)3052h469H151011H223H3(H222328)
MFCD02737818
ZINC000002746371
ZINC02746371
ZINC2746371
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