Vitas-M small molecule compound

tert-butyl {4-[(2E)-2-(3-methoxy-7,8,9,10-tetrahydro-6H-benzo[c]chromen-6-ylidene)hydrazinyl]-4-oxobutyl}carbamate

Catalog ID
STK627540
SMILES COc1ccc2c(c1)o/c(=N/NC(=O)CCCNC(=O)OC(C)(C)C)/c1c2CCCC1

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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 C23H31N3O5 MW 429.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31N3O5/c1-23(2,3)31-22(28)24-13-7-10-20(27)25-26-21-18-9-6-5-8-16(18)17-12-11-15(29-4)14-19(17)30-21/h11-12,14H,5-10,13H2,1-4H3,(H,24,28)(H,25,27)/b26-21+
InChIKey
YQJJEQJOLRVJEA-YYADALCUSA-N
Synonyms
929849-20-7
(E)tertbutyl(4(2(3methoxy78910tetrahydro6Hbenzo(c)chromen6ylidene)hydrazinyl)4oxobutyl)carbamate
929849207
CC(C)(C)OC(=O)NCCCC(=O)NN=C1C2=C(CCCC2)C3=C(O1)C=C(C=C3)OC
COc1ccc2c(c1)oc(=NNC(=O)CCCNC(=O)OC(C)(C)C)c1c2CCCC1
InChI=1SC23H31N3O5c123(23)3122(28)241371020(27)25262118965816(18)17121115(294)1419(17)3021h111214H51013H214H3(H2428)(H2527)b2621+
MFCD08745203
tertbutyl(4((2E)2(3methoxy78910tetrahydro6Hbenzo(c)chromen6ylidene)hydrazinyl)4oxobutyl)carbamate
tertbutylN(4((2E)2(3methoxy78910tetrahydrobenzo(c)chromen6ylidene)hydrazinyl)4oxobutyl)carbamate
ZINC000032035736
ZINC102734703

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.