Vitas-M small molecule compound

ethyl 4-(1,3-benzodioxol-5-yl)-2-oxo-6-(1H-1,2,4-triazol-1-ylmethyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK782115
SMILES CCOC(=O)C1=C(NC(=O)NC1c1ccc2c(c1)OCO2)Cn1cncn1

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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 C17H17N5O5 MW 371.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N5O5/c1-2-25-16(23)14-11(6-22-8-18-7-19-22)20-17(24)21-15(14)10-3-4-12-13(5-10)27-9-26-12/h3-5,7-8,15H,2,6,9H2,1H3,(H2,20,21,24)
InChIKey
OVUCPXJGSIAKGJ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(NC(=O)NC1C2=CC3=C(C=C2)OCO3)CN4C=NC=N4
ETHYL4(13BENZODIOXOL5YL)2OXO6(124TRIAZOL1YLMETHYL)34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ethyl4(13benzodioxol5yl)2oxo6(1H124triazol1ylmethyl)1234tetrahydropyrimidine5carboxylate
InChI=1SC17H17N5O5c122516(23)1411(62281871922)2017(24)2115(14)10341213(510)2792612h357815H269H21H3(H2202124)
MFCD06016660
ZINC000004727530
ZINC000004727531

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Available files

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