Vitas-M small molecule compound
4-methyl-N-{2-methyl-1-[4-methyl-5-({2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]propyl}benzamide
Catalog ID
STK047339
SMILES O=C(Nc1ncc(s1)C)CSc1nnc(n1C)C(C(C)C)NC(=O)c1ccc(cc1)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 C21H26N6O2S2 MW 458.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N6O2S2/c1-12(2)17(24-19(29)15-8-6-13(3)7-9-15)18-25-26-21(27(18)5)30-11-16(28)23-20-22-10-14(4)31-20/h6-10,12,17H,11H2,1-5H3,(H,24,29)(H,22,23,28)InChIKey
OENNIBKOSPDWKP-UHFFFAOYSA-NSynonyms
4METHYLN(2METHYL1(4METHYL5((2((5METHYL13THIAZOL2YL)AMINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)PROPYL)BENZAMIDE
4METHYLN(2METHYL1(4METHYL5(2((5METHYL13THIAZOL2YL)AMINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)PROPYL)BENZAMIDE
CC1=CC=C(C=C1)C(=O)NC(C2=NN=C(N2C)SCC(=O)NC3=NC=C(S3)C)C(C)C
InChI=1SC21H26N6O2S2c112(2)17(2419(29)158613(3)7915)18252621(27(18)5)301116(28)2320221014(4)3120h6101217H11H215H3(H2429)(H222328)
MFCD03570110
O=C(Nc1ncc(s1)C)CSc1nnc(n1C)C(C(C)C)NC(=O)c1ccc(cc1)C
STK047339
ZINC000002830366
ZINC000002830367
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