Vitas-M small molecule compound

N-{3-[5-(methoxymethyl)-1H-1,2,4-triazol-3-yl]phenyl}-4,6-dimethyl-2-oxo-1-(tetrahydrofuran-2-ylmethyl)-1,2-dihydropyridine-3-carboxamide

Catalog ID
STL424692
SMILES COCc1[nH]nc(n1)c1cccc(c1)NC(=O)c1c(C)cc(n(c1=O)CC1CCCO1)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 C23H27N5O4 MW 437.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5O4/c1-14-10-15(2)28(12-18-8-5-9-32-18)23(30)20(14)22(29)24-17-7-4-6-16(11-17)21-25-19(13-31-3)26-27-21/h4,6-7,10-11,18H,5,8-9,12-13H2,1-3H3,(H,24,29)(H,25,26,27)
InChIKey
KMMBHFVWWRNGBB-UHFFFAOYSA-N
Synonyms
1676068-90-8
1676068908
CC1=CC(=C(C(=O)N1CC2CCCO2)C(=O)NC3=CC=CC(=C3)C4=NNC(=N4)COC)C
COCc1(nH)nc(n1)c1cccc(c1)NC(=O)c1c(C)cc(n(c1=O)CC1CCCO1)C
COCc1n(nH)c(n1)c1cccc(c1)NC(=O)c1c(C)cc(n(c1=O)CC1CCCO1)C
InChI=1SC23H27N5O4c1141015(2)28(12188593218)23(30)20(14)22(29)241774616(1117)212519(13313)262721h467101118H5891213H213H3(H2429)(H252627)
MFCD30709521
N(3(3(methoxymethyl)1H124triazol5yl)phenyl)46dimethyl2oxo1((tetrahydrofuran2yl)methyl)12dihydropyridine3carboxamide
N(3(5(methoxymethyl)1H124triazol3yl)phenyl)46dimethyl2oxo1(oxolan2ylmethyl)pyridine3carboxamide
N(3(5(methoxymethyl)1H124triazol3yl)phenyl)46dimethyl2oxo1(tetrahydrofuran2ylmethyl)12dihydropyridine3carboxamide
ZINC000218607407
ZINC000218607488

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Available files

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