Vitas-M small molecule compound

ethyl 2-({N-(3,4-dimethoxyphenyl)-N-[(4-methylphenyl)sulfonyl]glycyl}amino)benzoate

Catalog ID
STL120938
SMILES CCOC(=O)c1ccccc1NC(=O)CN(S(=O)(=O)c1ccc(cc1)C)c1ccc(c(c1)OC)OC

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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 C26H28N2O7S MW 512.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O7S/c1-5-35-26(30)21-8-6-7-9-22(21)27-25(29)17-28(19-12-15-23(33-3)24(16-19)34-4)36(31,32)20-13-10-18(2)11-14-20/h6-16H,5,17H2,1-4H3,(H,27,29)
InChIKey
MVLATJXXSNSTBK-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC(=C(C=C2)OC)OC)S(=O)(=O)C3=CC=C(C=C3)C
ETHYL2((2(34DIMETHOXYN(4METHYLPHENYL)SULFONYLANILINO)ACETYL)AMINO)BENZOATE
ethyl2((N(34dimethoxyphenyl)N((4methylphenyl)sulfonyl)glycyl)amino)benzoate
InChI=1SC26H28N2O7Sc153526(30)21867922(21)2725(29)1728(19121523(333)24(1619)344)36(3132)20131018(2)111420h616H517H214H3(H2729)
MFCD02135547
ZINC000001208450
ZINC01208450
ZINC1208450

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Available files

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