Vitas-M small molecule compound
4-tert-butyl-N-[(2E)-3-cyano-10-methyl-5-oxo-1-(tetrahydrofuran-2-ylmethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-2-ylidene]benzamide
Catalog ID
STK872359
SMILES N#Cc1cc2c(n(/c/1=N/C(=O)c1ccc(cc1)C(C)(C)C)CC1CCCO1)nc1n(c2=O)cccc1C
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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 C29H29N5O3 MW 495.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N5O3/c1-18-7-5-13-33-24(18)31-26-23(28(33)36)15-20(16-30)25(34(26)17-22-8-6-14-37-22)32-27(35)19-9-11-21(12-10-19)29(2,3)4/h5,7,9-13,15,22H,6,8,14,17H2,1-4H3/b32-25+InChIKey
PEYPKKQCIVRQAE-WGPBWIAQSA-NSynonyms
872118-80-4(E)4(tertbutyl)N(3cyano10methyl5oxo1((tetrahydrofuran2yl)methyl)1Hdipyrido(12a23d)pyrimidin2(5H)ylidene)benzamide
4tertbutylN((2E)3cyano10methyl5oxo1(tetrahydrofuran2ylmethyl)15dihydro2Hdipyrido(12a23d)pyrimidin2ylidene)benzamide
872118804
MFCD05699602
N#Cc1cc2c(n(c1=NC(=O)c1ccc(cc1)C(C)(C)C)CC1CCCO1)nc1n(c2=O)cccc1C
ZINC000009222970
ZINC000009222971
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