Vitas-M small molecule compound

N-({[(2Z)-3-oxo-2-(thiophen-2-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)-D-phenylalanine

Catalog ID
STK608335
SMILES O=C(N[C@@H](C(=O)O)Cc1ccccc1)COc1ccc2c(c1)O/C(=C\c1cccs1)/C2=O

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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 C24H19NO6S MW 449.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19NO6S/c26-22(25-19(24(28)29)11-15-5-2-1-3-6-15)14-30-16-8-9-18-20(12-16)31-21(23(18)27)13-17-7-4-10-32-17/h1-10,12-13,19H,11,14H2,(H,25,26)(H,28,29)/b21-13-/t19-/m1/s1
InChIKey
GNMTVCBCDVXQBQ-UOIFGXKSSA-N
Synonyms
1013983-07-7
(2R)2((2(((2Z)3oxo2(thiophen2ylmethylidene)1benzofuran6yl)oxy)acetyl)amino)3phenylpropanoicacid
(RZ)2(2((3oxo2(thiophen2ylmethylene)23dihydrobenzofuran6yl)oxy)acetamido)3phenylpropanoicacid
1013983077
C1=CC=C(C=C1)CC(C(=O)O)NC(=O)COC2=CC3=C(C=C2)C(=O)C(=CC4=CC=CS4)O3
InChI=1SC24H19NO6Sc2622(2519(24(28)29)11155213615)143016891820(1216)3121(23(18)27)131774103217h110121319H1114H2(H2526)(H2829)b2113t19m1s1
MFCD06771015
N((((2Z)3oxo2(thiophen2ylmethylidene)23dihydro1benzofuran6yl)oxy)acetyl)Dphenylalanine
O=C(N(C@@H)(C(=O)O)Cc1ccccc1)COc1ccc2c(c1)OC(=Cc1cccs1)C2=O
ZINC000009446741
ZINC9446741

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Available files

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