Vitas-M small molecule compound
N-{1-[5-({2-[(5-cyclopropyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-2-methylpropyl}benzamide
Catalog ID
STK278771
SMILES O=C(Nc1nnc(s1)C1CC1)CSc1nnc(n1C)C(C(C)C)NC(=O)c1ccccc1
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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 C21H25N7O2S2 MW 471.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N7O2S2/c1-12(2)16(23-18(30)13-7-5-4-6-8-13)17-24-27-21(28(17)3)31-11-15(29)22-20-26-25-19(32-20)14-9-10-14/h4-8,12,14,16H,9-11H2,1-3H3,(H,23,30)(H,22,26,29)InChIKey
PVGANLHLROKNAV-UHFFFAOYSA-NSynonyms
CC(C)C(C1=NN=C(N1C)SCC(=O)NC2=NN=C(S2)C3CC3)NC(=O)C4=CC=CC=C4
InChI=1SC21H25N7O2S2c112(2)16(2318(30)137546813)17242721(28(17)3)311115(29)2220262519(3220)1491014h48121416H911H213H3(H2330)(H222629)
MFCD09269543
N(1(5((2((5cyclopropyl134thiadiazol2yl)amino)2oxoethyl)sulfanyl)4methyl4H124triazol3yl)2methylpropyl)benzamide
N(1(5((5CYCLOPROPYL(134)THIADIAZOL2YLCARBAMOYL)METHYLSULFANYL)4METHYL4H(124)TRIAZOL3YL)2METHYLPROPYL)BENZAMIDE
N(1(5(2((5cyclopropyl134thiadiazol2yl)amino)2oxoethyl)sulfanyl4methyl124triazol3yl)2methylpropyl)benzamide
ZINC000009095926
ZINC000009095927
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