Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carboxylic acid
Catalog ID
STK689683
SMILES Nc1nonc1n1nnc(c1CSc1nnc2c(n1)n(C)c1c2cccc1)C(=O)O
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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 C16H12N10O3S MW 424.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N10O3S/c1-25-8-5-3-2-4-7(8)10-13(25)18-16(21-19-10)30-6-9-11(15(27)28)20-24-26(9)14-12(17)22-29-23-14/h2-5H,6H2,1H3,(H2,17,22)(H,27,28)InChIKey
FFUMTYNPMWVHMY-UHFFFAOYSA-NSynonyms
1(4amino125oxadiazol3yl)5(((5methyl5H(124)triazino(56b)indol3yl)sulfanyl)methyl)1H123triazole4carboxylicacid
1(4amino125oxadiazol3yl)5((5methyl(124)triazino(56b)indol3yl)sulfanylmethyl)triazole4carboxylicacid
CN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC4=C(N=NN4C5=NON=C5N)C(=O)O
InChI=1SC16H12N10O3Sc125853247(8)1013(25)1816(211910)306911(15(27)28)202426(9)1412(17)22292314h25H6H21H3(H21722)(H2728)
MFCD09062577
ZINC000012428113
ZINC12428113
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