Vitas-M small molecule compound

ethyl 5-(diethylcarbamoyl)-4-methyl-2-({[3-(propan-2-yloxy)phenyl]carbonyl}amino)thiophene-3-carboxylate

Catalog ID
STK425304
SMILES CCOC(=O)c1c(NC(=O)c2cccc(c2)OC(C)C)sc(c1C)C(=O)N(CC)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 C23H30N2O5S MW 446.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N2O5S/c1-7-25(8-2)22(27)19-15(6)18(23(28)29-9-3)21(31-19)24-20(26)16-11-10-12-17(13-16)30-14(4)5/h10-14H,7-9H2,1-6H3,(H,24,26)
InChIKey
OXOMCLIENAVAMG-UHFFFAOYSA-N
Synonyms

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)OC(C)C)C(=O)OCC)C
ETHYL5((DIETHYLAMINO)CARBONYL)2((3ISOPROPOXYBENZOYL)AMINO)4METHYL3THIOPHENECARBOXYLATE
ethyl5(diethylcarbamoyl)4methyl2(((3(propan2yloxy)phenyl)carbonyl)amino)thiophene3carboxylate
ETHYL5(DIETHYLCARBAMOYL)4METHYL2((3PROPAN2YLOXYBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL5(NNDIETHYLCARBAMOYL)4METHYL2((3(METHYLETHOXY)PHENYL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC23H30N2O5Sc1725(82)22(27)1915(6)18(23(28)2993)21(3119)2420(26)1611101217(1316)3014(4)5h1014H79H216H3(H2426)
MFCD02375035
ZINC000000649578
ZINC00649578
ZINC649578

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Available files

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