Vitas-M small molecule compound
(2Z)-2-{[3,5-dimethyl-1-(propan-2-yl)-1H-pyrazol-4-yl]methylidene}-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one
Catalog ID
STL317902
SMILES COc1cc2c(cc1OC)C/C(=C/c1c(C)nn(c1C)C(C)C)/C2=O
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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 C20H24N2O3 MW 340.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O3/c1-11(2)22-13(4)16(12(3)21-22)8-15-7-14-9-18(24-5)19(25-6)10-17(14)20(15)23/h8-11H,7H2,1-6H3/b15-8-InChIKey
DCWMFBKWRMYRPQ-NVNXTCNLSA-NSynonyms
1436016-20-4(2Z)2((35dimethyl1(propan2yl)1Hpyrazol4yl)methylidene)56dimethoxy23dihydro1Hinden1one
(2Z)2((35dimethyl1propan2ylpyrazol4yl)methylidene)56dimethoxy3Hinden1one
(Z)2((1isopropyl35dimethyl1Hpyrazol4yl)methylene)56dimethoxy23dihydro1Hinden1one
1436016204
CC1=C(C(=NN1C(C)C)C)C=C2CC3=CC(=C(C=C3C2=O)OC)OC
COc1cc2c(cc1OC)CC(=Cc1c(C)nn(c1C)C(C)C)C2=O
InChI=1SC20H24N2O3c111(2)2213(4)16(12(3)2122)815714918(245)19(256)1017(14)20(15)23h811H7H216H3b158
MFCD23139959
ZINC000095478899
ZINC95478899
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