Vitas-M small molecule compound
(2E)-3-[3-(1H-benzotriazol-1-ylmethyl)-4-methoxyphenyl]-1-(1-hydroxynaphthalen-2-yl)prop-2-en-1-one
Catalog ID
STK831611
SMILES COc1ccc(cc1Cn1nnc2c1cccc2)/C=C/C(=O)c1ccc2c(c1O)cccc2
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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 C27H21N3O3 MW 435.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O3/c1-33-26-15-11-18(16-20(26)17-30-24-9-5-4-8-23(24)28-29-30)10-14-25(31)22-13-12-19-6-2-3-7-21(19)27(22)32/h2-16,32H,17H2,1H3/b14-10+InChIKey
INXGWDZFNZKCLO-GXDHUFHOSA-NSynonyms
378204-11-6(2E)3(3(1Hbenzotriazol1ylmethyl)4methoxyphenyl)1(1hydroxynaphthalen2yl)prop2en1one
(E)3(3((1Hbenzo(d)(123)triazol1yl)methyl)4methoxyphenyl)1(1hydroxynaphthalen2yl)prop2en1one
(E)3(3(BENZOTRIAZOL1YLMETHYL)4METHOXYPHENYL)1(1HYDROXYNAPHTHALEN2YL)PROP2EN1ONE
378204116
COC1=C(C=C(C=C1)C=CC(=O)C2=C(C3=CC=CC=C3C=C2)O)CN4C5=CC=CC=C5N=N4
COc1ccc(cc1Cn1nnc2c1cccc2)C=CC(=O)c1ccc2c(c1O)cccc2
InChI=1SC27H21N3O3c13326151118(1620(26)173024954823(24)282930)101425(31)22131219623721(19)27(22)32h21632H17H21H3b1410+
MFCD02373277
ZINC000013785290
ZINC13785290
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