Vitas-M small molecule compound
methyl 5-carbamoyl-2-({[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)-4-methylthiophene-3-carboxylate
Catalog ID
STK467604
SMILES COC(=O)c1c(NC(=O)CSc2nnc(n2CC)c2ccccc2)sc(c1C)C(=O)N
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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 C20H21N5O4S2 MW 459.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O4S2/c1-4-25-17(12-8-6-5-7-9-12)23-24-20(25)30-10-13(26)22-18-14(19(28)29-3)11(2)15(31-18)16(21)27/h5-9H,4,10H2,1-3H3,(H2,21,27)(H,22,26)InChIKey
RVADROBOGIRFNO-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=C(C(=C(S2)C(=O)N)C)C(=O)OC)C3=CC=CC=C3
InChI=1SC20H21N5O4S2c142517(128657912)232420(25)301013(26)221814(19(28)293)11(2)15(3118)16(21)27h59H410H213H3(H22127)(H2226)
methyl5carbamoyl2((((4ethyl5phenyl4H124triazol3yl)sulfanyl)acetyl)amino)4methylthiophene3carboxylate
methyl5carbamoyl2((2((4ethyl5phenyl124triazol3yl)sulfanyl)acetyl)amino)4methylthiophene3carboxylate
METHYL5CARBAMOYL2(2(4ETHYL5PHENYL(124TRIAZOL3YLTHIO))ACETYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD06072301
ZINC000020214216
ZINC20214216
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