Vitas-M small molecule compound

4-chloro-N-{[5-({1-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-1-oxopropan-2-yl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]methyl}benzamide

Catalog ID
STK230644
SMILES CCn1c(CNC(=O)c2ccc(cc2)Cl)nnc1SC(C(=O)Nc1sc(c(n1)C)C)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 C20H23ClN6O2S2 MW 479.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23ClN6O2S2/c1-5-27-16(10-22-18(29)14-6-8-15(21)9-7-14)25-26-20(27)31-13(4)17(28)24-19-23-11(2)12(3)30-19/h6-9,13H,5,10H2,1-4H3,(H,22,29)(H,23,24,28)
InChIKey
XVOSZHGAYSMEME-UHFFFAOYSA-N
Synonyms

4chloroN((5((1((45dimethyl13thiazol2yl)amino)1oxopropan2yl)sulfanyl)4ethyl4H124triazol3yl)methyl)benzamide
4CHLORON((5(1((45DIMETHYL13THIAZOL2YL)AMINO)1OXOPROPAN2YL)SULFANYL4ETHYL124TRIAZOL3YL)METHYL)BENZAMIDE
CCN1C(=NN=C1SC(C)C(=O)NC2=NC(=C(S2)C)C)CNC(=O)C3=CC=C(C=C3)Cl
InChI=1SC20H23ClN6O2S2c152716(102218(29)146815(21)9714)252620(27)3113(4)17(28)24192311(2)12(3)3019h6913H510H214H3(H2229)(H232428)
MFCD07790710
ZINC000009289797
ZINC000009289799

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Available files

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