Vitas-M small molecule compound

N-[1-(4-chlorobenzyl)-5-methyl-1H-pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide

Catalog ID
STK450444
SMILES Clc1ccc(cc1)Cn1nc(cc1C)NC(=O)c1ccc2c(c1)OCO2

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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 C19H16ClN3O3 MW 369.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClN3O3/c1-12-8-18(22-23(12)10-13-2-5-15(20)6-3-13)21-19(24)14-4-7-16-17(9-14)26-11-25-16/h2-9H,10-11H2,1H3,(H,21,22,24)
InChIKey
VDKCSHOZFDTDMT-UHFFFAOYSA-N
Synonyms

2HBENZO(34D)13DIOXOLAN5YLN(1((4CHLOROPHENYL)METHYL)5METHYLPYRAZOL3YL)CARBOXAMIDE
CC1=CC(=NN1CC2=CC=C(C=C2)Cl)NC(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC19H16ClN3O3c112818(2223(12)10132515(20)6313)2119(24)14471617(914)26112516h29H1011H21H3(H212224)
MFCD03757927
N(1((4CHLOROPHENYL)METHYL)5METHYLPYRAZOL3YL)13BENZODIOXOLE5CARBOXAMIDE
N(1(4chlorobenzyl)5methyl1Hpyrazol3yl)13benzodioxole5carboxamide
ZINC000002762017
ZINC02762017
ZINC2762017

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Available files

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