Vitas-M small molecule compound
1-(3-chlorobenzyl)-5-phenyl-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Catalog ID
STL081454
SMILES Clc1cccc(c1)CN1N=NC2C1C(=O)N(C2=O)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 C17H13ClN4O2 MW 340.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN4O2/c18-12-6-4-5-11(9-12)10-21-15-14(19-20-21)16(23)22(17(15)24)13-7-2-1-3-8-13/h1-9,14-15H,10H2InChIKey
PTSFIWKTNVDUKK-UHFFFAOYSA-NSynonyms
1(3chlorobenzyl)5phenyl3a6adihydropyrrolo(34d)(123)triazole46(1H5H)dione
3((3chlorophenyl)methyl)5phenyl3a6adihydropyrrolo(34d)triazole46dione
C1=CC=C(C=C1)N2C(=O)C3C(C2=O)N(N=N3)CC4=CC(=CC=C4)Cl
InChI=1SC17H13ClN4O2c181264511(912)10211514(192021)16(23)22(17(15)24)137213813h191415H10H2
MFCD07655588
ZINC000004483587
ZINC000101417214
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