Vitas-M small molecule compound

propan-2-yl 2-{[(3-chloro-1-benzothiophen-2-yl)carbonyl]amino}-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate

Catalog ID
STK432444
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC(C)C)NC(=O)c1sc2c(c1Cl)cccc2)CC

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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 C23H25ClN2O4S2 MW 493.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25ClN2O4S2/c1-6-26(7-2)22(28)18-13(5)16(23(29)30-12(3)4)21(32-18)25-20(27)19-17(24)14-10-8-9-11-15(14)31-19/h8-12H,6-7H2,1-5H3,(H,25,27)
InChIKey
QUNQTLBHATVMNL-UHFFFAOYSA-N
Synonyms

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C(=O)OC(C)C)C
InChI=1SC23H25ClN2O4S2c1626(72)22(28)1813(5)16(23(29)3012(3)4)21(3218)2520(27)1917(24)1410891115(14)3119h812H67H215H3(H2527)
ISOPROPYL2(((3CHLORO1BENZOTHIEN2YL)CARBONYL)AMINO)5((DIETHYLAMINO)CARBONYL)4METHYL3THIOPHENECARBOXYLATE
METHYLETHYL5(NNDIETHYLCARBAMOYL)2((3CHLOROBENZO(B)THIOPHEN2YL)CARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD03365919
propan2yl2(((3chloro1benzothiophen2yl)carbonyl)amino)5(diethylcarbamoyl)4methylthiophene3carboxylate
PROPAN2YL2((3CHLORO1BENZOTHIOPHENE2CARBONYL)AMINO)5(DIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ZINC000000670600
ZINC00670600
ZINC670600

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Available files

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