Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Catalog ID
STL512663
SMILES O=c1n(cnc2c1[nH]c1c2cccc1)Cc1ccc2c(c1)OCO2
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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 C18H13N3O3 MW 319.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N3O3/c22-18-17-16(12-3-1-2-4-13(12)20-17)19-9-21(18)8-11-5-6-14-15(7-11)24-10-23-14/h1-7,9,20H,8,10H2InChIKey
PCBQJWGTXQBQMH-UHFFFAOYSA-NSynonyms
374702-43-93(13benzodioxol5ylmethyl)35dihydro4Hpyrimido(54b)indol4one
3(13benzodioxol5ylmethyl)5~(H)pyrimido(54b)indol4one
3(13BENZODIOXOL5YLMETHYL)5HPYRIMIDO(54B)INDOL4ONE
3(BENZO(D)(13)DIOXOL5YLMETHYL)3HPYRIMIDO(54B)INDOL4(5H)ONE
374702439
929232
InChI=1SC18H13N3O3c22181716(12312413(12)2017)19921(18)811561415(711)24102314h17920H810H2
MFCD01881008
O=c1n(cnc2c1(nH)c1c2cccc1)Cc1ccc2c(c1)OCO2
ZINC000000519779
ZINC519779
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