Vitas-M small molecule compound

Catalog ID
STL053037
SMILES CCC([C@@H](C(=O)OC)NC(=O)NCc1cccs1)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 C13H20N2O3S MW 284.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H20N2O3S/c1-4-9(2)11(12(16)18-3)15-13(17)14-8-10-6-5-7-19-10/h5-7,9,11H,4,8H2,1-3H3,(H2,14,15,17)/t9?,11-/m0/s1
InChIKey
DYMBGNUNNYNDTO-UMJHXOGRSA-N
Synonyms
958843-57-7
(2S3R)methyl3methyl2(3(thiophen2ylmethyl)ureido)pentanoate
958843577
CCC((C@@H)(C(=O)OC)NC(=O)NCc1cccs1)C
CCC(C)C(C(=O)OC)NC(=O)NCC1=CC=CS1
InChI=1SC13H20N2O3Sc149(2)11(12(16)183)1513(17)148106571910h57911H48H213H3(H2141517)t9?11m0s1
METHYL(2S)3METHYL2(THIOPHEN2YLMETHYLCARBAMOYLAMINO)PENTANOATE
MFCD04169379
ZINC000002416977
ZINC000004302085

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.