Vitas-M small molecule compound
tert-butyl (1-{(2E)-2-[(6-methyl-4-oxo-4H-chromen-3-yl)methylidene]hydrazinyl}-1-oxo-3-phenylpropan-2-yl)carbamate (non-preferred name)
Catalog ID
STL234173
SMILES O=C(OC(C)(C)C)NC(C(=O)N/N=C/c1coc2c(c1=O)cc(cc2)C)Cc1ccccc1
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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 C25H27N3O5 MW 449.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O5/c1-16-10-11-21-19(12-16)22(29)18(15-32-21)14-26-28-23(30)20(13-17-8-6-5-7-9-17)27-24(31)33-25(2,3)4/h5-12,14-15,20H,13H2,1-4H3,(H,27,31)(H,28,30)/b26-14+InChIKey
YYDYLVSDJWSUNS-VULFUBBASA-NSynonyms
(SE)tertbutyl(1(2((6methyl4oxo4Hchromen3yl)methylene)hydrazinyl)1oxo3phenylpropan2yl)carbamate
CC1=CC2=C(C=C1)OC=C(C2=O)C=NNC(=O)C(CC3=CC=CC=C3)NC(=O)OC(C)(C)C
InChI=1SC25H27N3O5c11610112119(1216)22(29)18(153221)14262823(30)20(13178657917)2724(31)3325(23)4h512141520H13H214H3(H2731)(H2830)b2614+
MFCD24858423
O=C(OC(C)(C)C)N(C@H)(C(=O)NN=Cc1coc2c(c1=O)cc(cc2)C)Cc1ccccc1
O=C(OC(C)(C)C)NC(C(=O)NN=Cc1coc2c(c1=O)cc(cc2)C)Cc1ccccc1
tertbutyl(1((2E)2((6methyl4oxo4Hchromen3yl)methylidene)hydrazinyl)1oxo3phenylpropan2yl)carbamate(nonpreferredname)
tertbutylN(1((2E)2((6methyl4oxochromen3yl)methylidene)hydrazinyl)1oxo3phenylpropan2yl)carbamate
ZINC000009479760
ZINC000016001322
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.