Vitas-M small molecule compound
2-({4-methyl-5-[(5,6,7,8-tetrahydronaphthalen-2-yloxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide
Catalog ID
STK231136
SMILES Cc1nnc(s1)NC(=O)C(Sc1nnc(n1C)COc1ccc2c(c1)CCCC2)C
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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 C20H24N6O2S2 MW 444.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N6O2S2/c1-12(18(27)21-19-24-22-13(2)30-19)29-20-25-23-17(26(20)3)11-28-16-9-8-14-6-4-5-7-15(14)10-16/h8-10,12H,4-7,11H2,1-3H3,(H,21,24,27)InChIKey
IPUHGHFZBXLXBU-UHFFFAOYSA-NSynonyms
2((4methyl5((5678tetrahydronaphthalen2yloxy)methyl)4H124triazol3yl)sulfanyl)N(5methyl134thiadiazol2yl)propanamide
2((4methyl5(5678tetrahydronaphthalen2yloxymethyl)124triazol3yl)sulfanyl)N(5methyl134thiadiazol2yl)propanamide
CC1=NN=C(S1)NC(=O)C(C)SC2=NN=C(N2C)COC3=CC4=C(CCCC4)C=C3
InChI=1SC20H24N6O2S2c112(18(27)2119242213(2)3019)2920252317(26(20)3)1128169814645715(14)1016h81012H4711H213H3(H212427)
MFCD07791932
ZINC000009304129
ZINC000009304132
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