Vitas-M small molecule compound

Catalog ID
STK577135
SMILES CCC([C@@H](C(=O)O)NC(=O)c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)C

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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 C24H25N3O5 MW 435.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O5/c1-3-14(2)20(23(30)31)25-21(28)15-8-10-18(11-9-15)27-22(29)19-12-16-6-4-5-7-17(16)13-26(19)24(27)32/h4-11,14,19-20H,3,12-13H2,1-2H3,(H,25,28)(H,30,31)/t14?,19-,20-/m0/s1
InChIKey
WZPOGRXDAQHQKR-JEYZWWAPSA-N
Synonyms
1014003-71-4
(2S)2((4((10aS)13dioxo1010adihydro5Himidazo(15b)isoquinolin2yl)benzoyl)amino)3methylpentanoicacid
(2S3R)2(4((S)13dioxo1010adihydroimidazo(15b)isoquinolin2(1H3H5H)yl)benzamido)3methylpentanoicacid
1014003714
CCC((C@@H)(C(=O)O)NC(=O)c1ccc(cc1)N1C(=O)(C@H)2N(C1=O)Cc1c(C2)cccc1)C
CCC(C)C(C(=O)O)NC(=O)C1=CC=C(C=C1)N2C(=O)C3CC4=CC=CC=C4CN3C2=O
InChI=1SC24H25N3O5c1314(2)20(23(30)31)2521(28)1581018(11915)2722(29)191216645717(16)1326(19)24(27)32h411141920H31213H212H3(H2528)(H3031)t14?1920m0s1
MFCD07638825
ZINC000013577056
ZINC000013577058

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Available files

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