Vitas-M small molecule compound
3-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-2,8-dimethyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Catalog ID
STL333152
SMILES COc1cc(ccc1OC)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cc(cc1)C
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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 C21H20N4O3 MW 376.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O3/c1-12-5-7-16-15(9-12)19-20(24-16)21(26)25(13(2)23-19)22-11-14-6-8-17(27-3)18(10-14)28-4/h5-11,24H,1-4H3/b22-11+InChIKey
KEKPOJJCUQPPQO-SSDVNMTOSA-NSynonyms
487024-00-0(E)3((34dimethoxybenzylidene)amino)28dimethyl3Hpyrimido(54b)indol4(5H)one
3(((E)(34dimethoxyphenyl)methylidene)amino)28dimethyl35dihydro4Hpyrimido(54b)indol4one
3((E)(34DIMETHOXYPHENYL)METHYLIDENEAMINO)28DIMETHYL5HPYRIMIDO(54B)INDOL4ONE
487024000
CC1=CC2=C(C=C1)NC3=C2N=C(N(C3=O)N=CC4=CC(=C(C=C4)OC)OC)C
COc1cc(ccc1OC)C=Nn1c(C)nc2c(c1=O)(nH)c1c2cc(cc1)C
InChI=1SC21H20N4O3c112571615(912)1920(2416)21(26)25(13(2)2319)2211146817(273)18(1014)284h51124H14H3b2211+
MFCD03286594
ZINC000002321183
ZINC33360524
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