Vitas-M small molecule compound

4-methyl-3-[(N-propylalanyl)amino]thiophene-2-carboxylic acid

Catalog ID
STK993692
SMILES CCCNC(C(=O)Nc1c(C)csc1C(=O)O)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 C12H18N2O3S MW 270.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18N2O3S/c1-4-5-13-8(3)11(15)14-9-7(2)6-18-10(9)12(16)17/h6,8,13H,4-5H2,1-3H3,(H,14,15)(H,16,17)
InChIKey
LUPKINKNYDFRIB-UHFFFAOYSA-N
Synonyms
114176-52-2
114176522
2CARBOXYARTICAINE
2THIOPHENECARBOXYLICACID4METHYL3((1OXO2(PROPYLAMINO)PROPYL)AMINO)
4methyl3((Npropylalanyl)amino)thiophene2carboxylicacid
4METHYL3(2(PROPYLAMINO)PROPANAMIDO)THIOPHENE2CARBOXYLICACID
4METHYL3(2(PROPYLAMINO)PROPANOYLAMINO)THIOPHENE2CARBOXYLICACID
CCCNC(C)C(=O)NC1=C(SC=C1C)C(=O)O
InChI=1SC12H18N2O3Sc145138(3)11(15)1497(2)61810(9)12(16)17h6813H45H213H3(H1415)(H1617)
MFCD08505633
ZINC000005834950
ZINC000005834973

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Available files

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