Vitas-M small molecule compound

1-{2-[(1,3-benzodioxol-5-ylmethyl)amino]-2-oxoethyl}-N-(4-ethoxyphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide

Catalog ID
STL143122
SMILES CCOc1ccc(cc1)NC(=O)c1nnn(c1C)CC(=O)NCc1ccc2c(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 C22H23N5O5 MW 437.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O5/c1-3-30-17-7-5-16(6-8-17)24-22(29)21-14(2)27(26-25-21)12-20(28)23-11-15-4-9-18-19(10-15)32-13-31-18/h4-10H,3,11-13H2,1-2H3,(H,23,28)(H,24,29)
InChIKey
KZVMJTICECQWSR-UHFFFAOYSA-N
Synonyms

1(2((13benzodioxol5ylmethyl)amino)2oxoethyl)N(4ethoxyphenyl)5methyl1H123triazole4carboxamide
1(2(13benzodioxol5ylmethylamino)2oxoethyl)N(4ethoxyphenyl)5methyltriazole4carboxamide
CCOC1=CC=C(C=C1)NC(=O)C2=C(N(N=N2)CC(=O)NCC3=CC4=C(C=C3)OCO4)C
InChI=1SC22H23N5O5c1330177516(6817)2422(29)2114(2)27(262521)1220(28)231115491819(1015)32133118h410H31113H212H3(H2328)(H2429)
MFCD20748169
ZINC000071327463
ZINC71327463

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Available files

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