Vitas-M small molecule compound
5,8-dimethyl-3-(3-methylphenyl)-1-[3-(trifluoromethyl)benzyl]-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Catalog ID
STL135127
SMILES Cc1cccc(c1)n1c(=O)c2n(C)c3c(c2n(c1=O)Cc1cccc(c1)C(F)(F)F)cc(cc3)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 C27H22F3N3O2 MW 477.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22F3N3O2/c1-16-6-4-9-20(12-16)33-25(34)24-23(21-13-17(2)10-11-22(21)31(24)3)32(26(33)35)15-18-7-5-8-19(14-18)27(28,29)30/h4-14H,15H2,1-3H3InChIKey
OYIPYYIXRKISHG-UHFFFAOYSA-NSynonyms
58dimethyl3(3methylphenyl)1((3(trifluoromethyl)phenyl)methyl)pyrimido(54b)indole24dione
58dimethyl3(3methylphenyl)1(3(trifluoromethyl)benzyl)1Hpyrimido(54b)indole24(3H5H)dione
CC1=CC(=CC=C1)N2C(=O)C3=C(C4=C(N3C)C=CC(=C4)C)N(C2=O)CC5=CC(=CC=C5)C(F)(F)F
InChI=1SC27H22F3N3O2c11664920(1216)3325(34)2423(211317(2)101122(21)31(24)3)32(26(33)35)151875819(1418)27(2829)30h414H15H213H3
MFCD14913987
ZINC000020558132
ZINC20558132
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