Vitas-M small molecule compound
5-methyl-N-(2-oxo-2H-chromen-7-yl)-1-(3-phenyl-2,1-benzoxazol-5-yl)-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL018065
SMILES O=c1ccc2c(o1)cc(cc2)NC(=O)c1nnn(c1C)c1ccc2c(c1)c(on2)c1ccccc1
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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 C26H17N5O4 MW 463.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H17N5O4/c1-15-24(26(33)27-18-9-7-16-8-12-23(32)34-22(16)13-18)28-30-31(15)19-10-11-21-20(14-19)25(35-29-21)17-5-3-2-4-6-17/h2-14H,1H3,(H,27,33)InChIKey
KHXACUCWGJIOBR-UHFFFAOYSA-NSynonyms
(5METHYL1(3PHENYLBENZO(C)ISOXAZOL5YL)(123TRIAZOL4YL))N(2OXOCHROMEN7YL)CARBOXAMIDE
5methylN(2oxo2Hchromen7yl)1(3phenyl21benzoxazol5yl)1H123triazole4carboxamide
5methylN(2oxochromen7yl)1(3phenyl21benzoxazol5yl)triazole4carboxamide
CC1=C(N=NN1C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4)C(=O)NC5=CC6=C(C=C5)C=CC(=O)O6
InChI=1SC26H17N5O4c11524(26(33)2718971681223(32)3422(16)1318)283031(15)1910112120(1419)25(352921)175324617h214H1H3(H2733)
MFCD10082037
ZINC000012274455
ZINC12274455
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