Vitas-M small molecule compound
4-{[3-(1H-benzotriazol-1-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl]amino}phenyl benzoate
Catalog ID
STK998103
SMILES O=C(c1ccccc1)Oc1ccc(cc1)NC1=C(C(=O)c2c(C1=O)cccc2)n1nnc2c1cccc2
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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 C29H18N4O4 MW 486.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H18N4O4/c34-27-21-10-4-5-11-22(21)28(35)26(33-24-13-7-6-12-23(24)31-32-33)25(27)30-19-14-16-20(17-15-19)37-29(36)18-8-2-1-3-9-18/h1-17,30HInChIKey
NXKWEAUUEMEHBO-UHFFFAOYSA-NSynonyms
497242-11-2(4((3(BENZOTRIAZOL1YL)14DIOXONAPHTHALEN2YL)AMINO)PHENYL)BENZOATE
4((3(1Hbenzo(d)(123)triazol1yl)14dioxo14dihydronaphthalen2yl)amino)phenylbenzoate
4((3(1Hbenzotriazol1yl)14dioxo14dihydronaphthalen2yl)amino)phenylbenzoate
497242112
C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)NC3=C(C(=O)C4=CC=CC=C4C3=O)N5C6=CC=CC=C6N=N5
InChI=1SC29H18N4O4c34272110451122(21)28(35)26(332413761223(24)313233)25(27)3019141620(171519)3729(36)188213918h11730H
MFCD03300134
ZINC000002334887
ZINC02334887
ZINC2334887
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