Vitas-M small molecule compound
{5-[(furan-2-ylmethyl)amino]-3-(4-methoxyphenyl)-1H-1,2,4-triazol-1-yl}(4-nitrophenyl)methanone
Catalog ID
STK825321
SMILES COc1ccc(cc1)c1nc(n(n1)C(=O)c1ccc(cc1)[N+](=O)[O-])NCc1ccco1
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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 C21H17N5O5 MW 419.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N5O5/c1-30-17-10-6-14(7-11-17)19-23-21(22-13-18-3-2-12-31-18)25(24-19)20(27)15-4-8-16(9-5-15)26(28)29/h2-12H,13H2,1H3,(H,22,23,24)InChIKey
YGZRBVPXNBGSGU-UHFFFAOYSA-NSynonyms
831247-21-3(5((furan2ylmethyl)amino)3(4methoxyphenyl)1H124triazol1yl)(4nitrophenyl)methanone
(5(FURAN2YLMETHYLAMINO)3(4METHOXYPHENYL)124TRIAZOL1YL)(4NITROPHENYL)METHANONE
831247213
COC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=CO3)C(=O)C4=CC=C(C=C4)(N+)(=O)(O)
COc1ccc(cc1)c1nc(n(n1)C(=O)c1ccc(cc1)(N+)(=O)(O))NCc1ccco1
InChI=1SC21H17N5O5c1301710614(71117)192321(22131832123118)25(2419)20(27)154816(9515)26(28)29h212H13H21H3(H222324)
MFCD07358685
ZINC000008766466
ZINC08766466
ZINC8766466
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