Vitas-M small molecule compound
ethyl 5-(acetyloxy)-1-benzyl-6,8-diphenyl-2-(piperidin-1-ylmethyl)-1,6-dihydropyrrolo[2,3-e]indazole-3-carboxylate
Catalog ID
STK526014
SMILES CCOC(=O)c1c2cc(OC(=O)C)c3c(c2n(c1CN1CCCCC1)Cc1ccccc1)c(nn3c1ccccc1)c1ccccc1
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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 C39H38N4O4 MW 626.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H38N4O4/c1-3-46-39(45)34-31-24-33(47-27(2)44)38-35(36(29-18-10-5-11-19-29)40-43(38)30-20-12-6-13-21-30)37(31)42(25-28-16-8-4-9-17-28)32(34)26-41-22-14-7-15-23-41/h4-6,8-13,16-21,24H,3,7,14-15,22-23,25-26H2,1-2H3InChIKey
SZKODXZIGOGICV-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(C2=C3C(=C(C=C12)OC(=O)C)N(N=C3C4=CC=CC=C4)C5=CC=CC=C5)CC6=CC=CC=C6)CN7CCCCC7
ethyl5(acetyloxy)1benzyl68diphenyl2(piperidin1ylmethyl)16dihydropyrrolo(23e)indazole3carboxylate
ethyl5acetoxy1benzyl68diphenyl2(piperidin1ylmethyl)16dihydropyrrolo(23e)indazole3carboxylate
ETHYL5ACETYLOXY1BENZYL68DIPHENYL2(PIPERIDIN1YLMETHYL)PYRROLO(23E)INDAZOLE3CARBOXYLATE
InChI=1SC39H38N4O4c134639(45)34312433(4727(2)44)3835(36(2918105111929)4043(38)3020126132130)37(31)42(2528168491728)32(34)264122147152341h46813162124H37141522232526H212H3
MFCD01856445
ZINC000100625013
ZINC100625013
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