Vitas-M small molecule compound

1-(2-chloro-5-methylphenyl)-N-cyclopentyl-5-methyl-1H-1,2,3-triazole-4-carboxamide

Catalog ID
STK953088
SMILES Cc1ccc(c(c1)n1nnc(c1C)C(=O)NC1CCCC1)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 C16H19ClN4O MW 318.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19ClN4O/c1-10-7-8-13(17)14(9-10)21-11(2)15(19-20-21)16(22)18-12-5-3-4-6-12/h7-9,12H,3-6H2,1-2H3,(H,18,22)
InChIKey
MVLWFEDFFSZXQL-UHFFFAOYSA-N
Synonyms
904816-54-2
(1(2CHLORO5METHYLPHENYL)5METHYL(123TRIAZOL4YL))NCYCLOPENTYLCARBOXAMIDE
1(2chloro5methylphenyl)Ncyclopentyl5methyl1H123triazole4carboxamide
1(2CHLORO5METHYLPHENYL)NCYCLOPENTYL5METHYLTRIAZOLE4CARBOXAMIDE
904816542
CC1=CC(=C(C=C1)Cl)N2C(=C(N=N2)C(=O)NC3CCCC3)C
InChI=1SC16H19ClN4Oc1107813(17)14(910)2111(2)15(192021)16(22)1812534612h7912H36H212H3(H1822)
MFCD08543158
ZINC000008022319
ZINC08022319
ZINC8022319

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Available files

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