Vitas-M small molecule compound
3-(4-chlorophenyl)-5-cyclohexyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl cyclohexanecarboxylate
Catalog ID
STK991223
SMILES Clc1ccc(cc1)n1cc(c2c1nc(C1CCCCC1)n1c2nc2c1cccc2)OC(=O)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 C31H31ClN4O2 MW 527.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31ClN4O2/c32-22-15-17-23(18-16-22)35-19-26(38-31(37)21-11-5-2-6-12-21)27-29(35)34-28(20-9-3-1-4-10-20)36-25-14-8-7-13-24(25)33-30(27)36/h7-8,13-21H,1-6,9-12H2InChIKey
ZNYBUSQWWJJTRD-UHFFFAOYSA-NSynonyms
849919-01-33(4chlorophenyl)5cyclohexyl3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1ylcyclohexanecarboxylate
3(4chlorophenyl)5cyclohexyl3Hpyrrolo(2345)pyrimido(16a)benzimidazol1ylcyclohexanecarboxylate
849919013
C1CCC(CC1)C2=NC3=C(C(=CN3C4=CC=C(C=C4)Cl)OC(=O)C5CCCCC5)C6=NC7=CC=CC=C7N26
InChI=1SC31H31ClN4O2c3222151723(181622)351926(3831(37)21115261221)2729(35)3428(2093141020)362514871324(25)3330(27)36h781321H16912H2
MFCD05689234
ZINC000008871250
ZINC08871250
ZINC8871250
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