Vitas-M small molecule compound
3-(3-chlorophenyl)-5-(2-methylpropyl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl 3-methylbutanoate
Catalog ID
STK716149
SMILES CC(CC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CC(C)C)cccc3)c1cccc(c1)Cl)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 C27H27ClN4O2 MW 474.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27ClN4O2/c1-16(2)12-23-30-26-25(27-29-20-10-5-6-11-21(20)32(23)27)22(34-24(33)13-17(3)4)15-31(26)19-9-7-8-18(28)14-19/h5-11,14-17H,12-13H2,1-4H3InChIKey
SJPJFNWHSBHYDZ-UHFFFAOYSA-NSynonyms
885201-95-63(3chlorophenyl)5(2methylpropyl)3Hpyrrolo(2345)pyrimido(16a)benzimidazol1yl3methylbutanoate
3(3chlorophenyl)5isobutyl3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1yl3methylbutanoate
885201956
CC(C)CC1=NC2=C(C(=CN2C3=CC(=CC=C3)Cl)OC(=O)CC(C)C)C4=NC5=CC=CC=C5N14
InChI=1SC27H27ClN4O2c116(2)1223302625(27292010561121(20)32(23)27)22(3424(33)1317(3)4)1531(26)1997818(28)1419h5111417H1213H214H3
MFCD06592631
ZINC000009293137
ZINC09293137
ZINC9293137
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