Vitas-M small molecule compound

(2Z)-3-oxo-2-(pyridin-4-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl diphenylcarbamate

Catalog ID
STK924250
SMILES O=C1/C(=C/c2ccncc2)/Oc2c1ccc(c2)OC(=O)N(c1ccccc1)c1ccccc1

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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 C27H18N2O4 MW 434.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18N2O4/c30-26-23-12-11-22(18-24(23)33-25(26)17-19-13-15-28-16-14-19)32-27(31)29(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-18H/b25-17-
InChIKey
RCRYHULEPCAXRH-UQQQWYQISA-N
Synonyms
622793-04-8
((2Z)3OXO2(PYRIDIN4YLMETHYLIDENE)1BENZOFURAN6YL)NNDIPHENYLCARBAMATE
(2Z)3oxo2(pyridin4ylmethylidene)23dihydro1benzofuran6yldiphenylcarbamate
(3OXO2(4PYRIDYLMETHYLENE)BENZO(34B)FURAN6YLOXY)NNDIBENZAMIDE
(Z)3oxo2(pyridin4ylmethylene)23dihydrobenzofuran6yldiphenylcarbamate
622793048
C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)OC3=CC4=C(C=C3)C(=O)C(=CC5=CC=NC=C5)O4
InChI=1SC27H18N2O4c302623121122(1824(23)3325(26)1719131528161419)3227(31)29(207314820)2195261021h118Hb2517
MFCD04174707
O=C1C(=Cc2ccncc2)Oc2c1ccc(c2)OC(=O)N(c1ccccc1)c1ccccc1
ZINC000009282703
ZINC09282703
ZINC9282703

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Available files

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