Vitas-M small molecule compound
3,4-dimethoxy-N-{[5-({2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}benzamide
Catalog ID
STK131696
SMILES C=CCn1c(CNC(=O)c2ccc(c(c2)OC)OC)nnc1SCC(=O)Nc1scc(n1)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 C21H24N6O4S2 MW 488.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N6O4S2/c1-5-8-27-17(10-22-19(29)14-6-7-15(30-3)16(9-14)31-4)25-26-21(27)33-12-18(28)24-20-23-13(2)11-32-20/h5-7,9,11H,1,8,10,12H2,2-4H3,(H,22,29)(H,23,24,28)InChIKey
CELKHRNWMYKBNC-UHFFFAOYSA-NSynonyms
34DIMETHOXYN((5((2((4METHYL13THIAZOL2YL)AMINO)2OXOETHYL)SULFANYL)4(PROP2EN1YL)4H124TRIAZOL3YL)METHYL)BENZAMIDE
34DIMETHOXYN((5(2((4METHYL13THIAZOL2YL)AMINO)2OXOETHYL)SULFANYL4PROP2ENYL124TRIAZOL3YL)METHYL)BENZAMIDE
CC1=CSC(=N1)NC(=O)CSC2=NN=C(N2CC=C)CNC(=O)C3=CC(=C(C=C3)OC)OC
InChI=1SC21H24N6O4S2c1582717(102219(29)146715(303)16(914)314)252621(27)331218(28)24202313(2)113220h57911H181012H224H3(H2229)(H232428)
MFCD05993489
ZINC000009261242
ZINC09261242
ZINC9261242
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