Vitas-M small molecule compound

N-benzyl-1-(3-chloro-4-methoxyphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide

Catalog ID
STL018182
SMILES COc1ccc(cc1Cl)n1nnc(c1C)C(=O)NCc1ccccc1

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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 C18H17ClN4O2 MW 356.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN4O2/c1-12-17(18(24)20-11-13-6-4-3-5-7-13)21-22-23(12)14-8-9-16(25-2)15(19)10-14/h3-10H,11H2,1-2H3,(H,20,24)
InChIKey
PJPFXWDYVNCCJO-UHFFFAOYSA-N
Synonyms

(1(3CHLORO4METHOXYPHENYL)5METHYL(123TRIAZOL4YL))NBENZYLCARBOXAMIDE
CC1=C(N=NN1C2=CC(=C(C=C2)OC)Cl)C(=O)NCC3=CC=CC=C3
InChI=1SC18H17ClN4O2c11217(18(24)2011136435713)212223(12)148916(252)15(19)1014h310H11H212H3(H2024)
MFCD10082199
Nbenzyl1(3chloro4methoxyphenyl)5methyl1H123triazole4carboxamide
Nbenzyl1(3chloro4methoxyphenyl)5methyltriazole4carboxamide
ZINC000012274719
ZINC12274719

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Available files

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