Vitas-M small molecule compound

propan-2-yl 4-ethyl-5-methyl-2-{[(2E)-3-(thiophen-2-yl)prop-2-enoyl]amino}thiophene-3-carboxylate

Catalog ID
STK444827
SMILES CCc1c(C)sc(c1C(=O)OC(C)C)NC(=O)/C=C/c1cccs1

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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 C18H21NO3S2 MW 363.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO3S2/c1-5-14-12(4)24-17(16(14)18(21)22-11(2)3)19-15(20)9-8-13-7-6-10-23-13/h6-11H,5H2,1-4H3,(H,19,20)/b9-8+
InChIKey
LZHNSRWDZOLGLD-CMDGGOBGSA-N
Synonyms

CCC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C=CC2=CC=CS2)C
CCc1c(C)sc(c1C(=O)OC(C)C)NC(=O)C=Cc1cccs1
InChI=1SC18H21NO3S2c151412(4)2417(16(14)18(21)2211(2)3)1915(20)981376102313h611H5H214H3(H1920)b98+
ISOPROPYL4ETHYL5METHYL2((3(2THIENYL)ACRYLOYL)AMINO)3THIOPHENECARBOXYLATE
METHYLETHYL2((2E)3(2THIENYL)PROP2ENOYLAMINO)4ETHYL5METHYLTHIOPHENE3CARBOXYLATE
MFCD01353887
propan2yl4ethyl5methyl2(((2E)3(thiophen2yl)prop2enoyl)amino)thiophene3carboxylate
PROPAN2YL4ETHYL5METHYL2(((E)3THIOPHEN2YLPROP2ENOYL)AMINO)THIOPHENE3CARBOXYLATE
ZINC000000688940
ZINC00688940
ZINC688940

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Available files

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