Vitas-M small molecule compound
2-(5-{[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)-N-(4-chlorophenyl)acetamide
Catalog ID
STK221693
SMILES O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1C)CC(=O)Nc1ccc(cc1)Cl
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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 C20H18ClN5O4S MW 459.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN5O4S/c1-26-17(9-18(27)22-13-4-2-12(21)3-5-13)24-25-20(26)31-10-19(28)23-14-6-7-15-16(8-14)30-11-29-15/h2-8H,9-11H2,1H3,(H,22,27)(H,23,28)InChIKey
UXKMLHBCCSWYPK-UHFFFAOYSA-NSynonyms
2(5((2(13BENZODIOXOL5YLAMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)N(4CHLOROPHENYL)ACETAMIDE
2(5(2(13BENZODIOXOL5YLAMINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)N(4CHLOROPHENYL)ACETAMIDE
2(5(BENZO(13)DIOXOL5YLCARBAMOYLMETHYLSULFANYL)4METHYL4H(124)TRIAZOL3YL)N(4CHLOROPHENYL)ACETAMIDE
CN1C(=NN=C1SCC(=O)NC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC=C(C=C4)Cl
InChI=1SC20H18ClN5O4Sc12617(918(27)22134212(21)3513)242520(26)311019(28)2314671516(814)30112915h28H911H21H3(H2227)(H2328)
MFCD07399326
ZINC000009263646
ZINC09263646
ZINC9263646
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