Vitas-M small molecule compound

methyl 4-chloro-3-({5-[(cyclopropylmethyl)carbamoyl]-1,2,4-oxadiazol-3-yl}methyl)benzoate

Catalog ID
STL154839
SMILES COC(=O)c1ccc(c(c1)Cc1noc(n1)C(=O)NCC1CC1)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 C16H16ClN3O4 MW 349.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClN3O4/c1-23-16(22)10-4-5-12(17)11(6-10)7-13-19-15(24-20-13)14(21)18-8-9-2-3-9/h4-6,9H,2-3,7-8H2,1H3,(H,18,21)
InChIKey
DJGUIDSHJBFAPU-UHFFFAOYSA-N
Synonyms
1246042-43-2
1246042432
COC(=O)C1=CC(=C(C=C1)Cl)CC2=NOC(=N2)C(=O)NCC3CC3
InChI=1SC16H16ClN3O4c12316(22)104512(17)11(610)7131915(242013)14(21)1889239h469H2378H21H3(H1821)
methyl4chloro3((5((cyclopropylmethyl)carbamoyl)124oxadiazol3yl)methyl)benzoate
methyl4chloro3((5(cyclopropylmethylcarbamoyl)124oxadiazol3yl)methyl)benzoate
MFCD18065396
ZINC000049543999
ZINC49543999

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Available files

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