Vitas-M small molecule compound
N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-({4-methyl-5-[(5,6,7,8-tetrahydronaphthalen-2-yloxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STK221927
SMILES O=C(Nc1nnc(s1)C1CC1)CSc1nnc(n1C)COc1ccc2c(c1)CCCC2
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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 C21H24N6O2S2 MW 456.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N6O2S2/c1-27-17(11-29-16-9-8-13-4-2-3-5-15(13)10-16)23-26-21(27)30-12-18(28)22-20-25-24-19(31-20)14-6-7-14/h8-10,14H,2-7,11-12H2,1H3,(H,22,25,28)InChIKey
BNZFKWIUORZEMX-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCC(=O)NC2=NN=C(S2)C3CC3)COC4=CC5=C(CCCC5)C=C4
InChI=1SC21H24N6O2S2c12717(1129169813423515(13)1016)232621(27)301218(28)2220252419(3120)146714h81014H271112H21H3(H222528)
MFCD07401645
N(5cyclopropyl134thiadiazol2yl)2((4methyl5((5678tetrahydronaphthalen2yloxy)methyl)4H124triazol3yl)sulfanyl)acetamide
N(5cyclopropyl134thiadiazol2yl)2((4methyl5(5678tetrahydronaphthalen2yloxymethyl)124triazol3yl)sulfanyl)acetamide
ZINC000009302887
ZINC09302887
ZINC9302887
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