Vitas-M small molecule compound
3-(3,4-dimethylphenyl)-5-(2-methylpropyl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl 3-methylbutanoate
Catalog ID
STK716209
SMILES CC(CC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CC(C)C)cccc3)c1ccc(c(c1)C)C)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 C29H32N4O2 MW 468.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N4O2/c1-17(2)13-25-31-28-27(29-30-22-9-7-8-10-23(22)33(25)29)24(35-26(34)14-18(3)4)16-32(28)21-12-11-19(5)20(6)15-21/h7-12,15-18H,13-14H2,1-6H3InChIKey
DVTVHETVDIUMIB-UHFFFAOYSA-NSynonyms
885175-78-03(34dimethylphenyl)5(2methylpropyl)3Hpyrrolo(2345)pyrimido(16a)benzimidazol1yl3methylbutanoate
3(34dimethylphenyl)5isobutyl3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1yl3methylbutanoate
885175780
CC1=C(C=C(C=C1)N2C=C(C3=C2N=C(N4C3=NC5=CC=CC=C54)CC(C)C)OC(=O)CC(C)C)C
InChI=1SC29H32N4O2c117(2)1325312827(2930229781023(22)33(25)29)24(3526(34)1418(3)4)1632(28)21121119(5)20(6)1521h7121518H1314H216H3
MFCD06602573
ZINC000002235757
ZINC02235757
ZINC2235757
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