Vitas-M small molecule compound
methyl 2-({[1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyl-1H-1,2,3-triazol-4-yl]carbonyl}amino)benzoate
Catalog ID
STK948871
SMILES CCCc1c(nnn1c1ccc2c(c1)c(on2)c1ccccc1)C(=O)Nc1ccccc1C(=O)OC
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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 C27H23N5O4 MW 481.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N5O4/c1-3-9-23-24(26(33)28-21-13-8-7-12-19(21)27(34)35-2)29-31-32(23)18-14-15-22-20(16-18)25(36-30-22)17-10-5-4-6-11-17/h4-8,10-16H,3,9H2,1-2H3,(H,28,33)InChIKey
YHJUJEOQRFVMIB-UHFFFAOYSA-NSynonyms
CCCC1=C(N=NN1C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4)C(=O)NC5=CC=CC=C5C(=O)OC
InChI=1SC27H23N5O4c1392324(26(33)282113871219(21)27(34)352)293132(23)1814152220(1618)25(363022)17105461117h481016H39H212H3(H2833)
methyl2(((1(3phenyl21benzoxazol5yl)5propyl1H123triazol4yl)carbonyl)amino)benzoate
methyl2((1(3phenyl21benzoxazol5yl)5propyltriazole4carbonyl)amino)benzoate
METHYL2((1(3PHENYLBENZO(C)ISOXAZOL5YL)5PROPYL123TRIAZOL4YL)CARBONYLAMINO)BENZOATE
MFCD12967893
ZINC000033026842
ZINC33026842
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