Vitas-M small molecule compound
1-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-N-(2-chlorophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL129750
SMILES O=C(Cn1nnc(c1C)C(=O)Nc1ccccc1Cl)Nc1ccc2c(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 C19H16ClN5O4 MW 413.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClN5O4/c1-11-18(19(27)22-14-5-3-2-4-13(14)20)23-24-25(11)9-17(26)21-12-6-7-15-16(8-12)29-10-28-15/h2-8H,9-10H2,1H3,(H,21,26)(H,22,27)InChIKey
PMGFFMNISBWKAE-UHFFFAOYSA-NSynonyms
1(2(13benzodioxol5ylamino)2oxoethyl)N(2chlorophenyl)5methyl1H123triazole4carboxamide
1(2(13benzodioxol5ylamino)2oxoethyl)N(2chlorophenyl)5methyltriazole4carboxamide
CC1=C(N=NN1CC(=O)NC2=CC3=C(C=C2)OCO3)C(=O)NC4=CC=CC=C4Cl
InChI=1SC19H16ClN5O4c11118(19(27)2214532413(14)20)232425(11)917(26)2112671516(812)29102815h28H910H21H3(H2126)(H2227)
MFCD20747825
ZINC000067322836
ZINC67322836
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