Vitas-M small molecule compound
5-amino-N-(3-fluorophenyl)-1-{2-[(2-methoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL094692
SMILES COc1ccccc1NC(=O)Cn1nnc(c1N)C(=O)Nc1cccc(c1)F
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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 C18H17FN6O3 MW 384.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17FN6O3/c1-28-14-8-3-2-7-13(14)22-15(26)10-25-17(20)16(23-24-25)18(27)21-12-6-4-5-11(19)9-12/h2-9H,10,20H2,1H3,(H,21,27)(H,22,26)InChIKey
ZQWKRGNTOHXWPC-UHFFFAOYSA-NSynonyms
5aminoN(3fluorophenyl)1(2((2methoxyphenyl)amino)2oxoethyl)1H123triazole4carboxamide
5aminoN(3fluorophenyl)1(2(2methoxyanilino)2oxoethyl)triazole4carboxamide
COC1=CC=CC=C1NC(=O)CN2C(=C(N=N2)C(=O)NC3=CC(=CC=C3)F)N
InChI=1SC18H17FN6O3c12814832713(14)2215(26)102517(20)16(232425)18(27)211264511(19)912h29H1020H21H3(H2127)(H2226)
MFCD14753537
ZINC000004971789
ZINC4971789
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