Vitas-M small molecule compound

ethyl 5-[(3-chlorophenyl)carbamoyl]-4-methyl-2-{[(3,4,5-trimethoxyphenyl)carbonyl]amino}thiophene-3-carboxylate

Catalog ID
STK375943
SMILES CCOC(=O)c1c(NC(=O)c2cc(OC)c(c(c2)OC)OC)sc(c1C)C(=O)Nc1cccc(c1)Cl

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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 C25H25ClN2O7S MW 533.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN2O7S/c1-6-35-25(31)19-13(2)21(23(30)27-16-9-7-8-15(26)12-16)36-24(19)28-22(29)14-10-17(32-3)20(34-5)18(11-14)33-4/h7-12H,6H2,1-5H3,(H,27,30)(H,28,29)
InChIKey
DMONWHRZSXYMMW-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC(=CC=C2)Cl)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC
ethyl5((3chlorophenyl)carbamoyl)4methyl2(((345trimethoxyphenyl)carbonyl)amino)thiophene3carboxylate
ETHYL5((3CHLOROPHENYL)CARBAMOYL)4METHYL2((345TRIMETHOXYBENZENE)AMIDO)THIOPHENE3CARBOXYLATE
ETHYL5((3CHLOROPHENYL)CARBAMOYL)4METHYL2((345TRIMETHOXYBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL5(N(3CHLOROPHENYL)CARBAMOYL)4METHYL2((345TRIMETHOXYPHENYL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC25H25ClN2O7Sc163525(31)1913(2)21(23(30)271697815(26)1216)3624(19)2822(29)141017(323)20(345)18(1114)334h712H6H215H3(H2730)(H2829)
MFCD01151588
ZINC000000629355
ZINC629355

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Available files

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