Vitas-M small molecule compound
3-[(4-methoxybenzyl)amino]-5-(phenylamino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Catalog ID
STK529568
SMILES COc1ccc(cc1)CNc1cc(Nc2ccccc2)c2c3c1noc3c1c(C2=O)cccc1
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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 C28H21N3O3 MW 447.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21N3O3/c1-33-19-13-11-17(12-14-19)16-29-23-15-22(30-18-7-3-2-4-8-18)24-25-26(23)31-34-28(25)21-10-6-5-9-20(21)27(24)32/h2-15,29-30H,16H2,1H3InChIKey
KLFXVGBRAUGTOF-UHFFFAOYSA-NSynonyms
3((4methoxybenzyl)amino)5(phenylamino)6Hanthra(19cd)(12)oxazol6one
3((4methoxybenzyl)amino)5(phenylamino)6Hanthra(19cd)isoxazol6one
COC1=CC=C(C=C1)CNC2=CC(=C3C4=C(C5=CC=CC=C5C3=O)ON=C24)NC6=CC=CC=C6
InChI=1SC28H21N3O3c13319131117(121419)1629231522(30187324818)242526(23)313428(25)211065920(21)27(24)32h2152930H16H21H3
MFCD02234880
ZINC000002292965
ZINC02292965
ZINC2292965
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