Vitas-M small molecule compound
3-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-5-(phenylamino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Catalog ID
STK528344
SMILES O=C1c2ccccc2c2c3c1c(Nc1ccccc1)cc(c3no2)NCCC1=CCCCC1
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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 C28H25N3O2 MW 435.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O2/c32-27-20-13-7-8-14-21(20)28-25-24(27)22(30-19-11-5-2-6-12-19)17-23(26(25)31-33-28)29-16-15-18-9-3-1-4-10-18/h2,5-9,11-14,17,29-30H,1,3-4,10,15-16H2InChIKey
JEOUHTGBDOHUTE-UHFFFAOYSA-NSynonyms
3((2(cyclohex1en1yl)ethyl)amino)5(phenylamino)6Hanthra(19cd)(12)oxazol6one
3((2(cyclohex1en1yl)ethyl)amino)5(phenylamino)6Hanthra(19cd)isoxazol6one
C1CCC(=CC1)CCNC2=CC(=C3C4=C(C5=CC=CC=C5C3=O)ON=C24)NC6=CC=CC=C6
InChI=1SC28H25N3O2c32272013781421(20)282524(27)22(3019115261219)1723(26(25)313328)2916151893141018h2591114172930H134101516H2
MFCD02233645
ZINC000002292027
ZINC02292027
ZINC2292027
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