Vitas-M small molecule compound
1-(4-amino-2-{4-[4-(4-fluorophenyl)piperazin-1-yl]-5-methyl-2-phenylthieno[2,3-d]pyrimidin-6-yl}-6-methylpyrimidin-5-yl)ethanone
Catalog ID
STK681918
SMILES Fc1ccc(cc1)N1CCN(CC1)c1nc(nc2c1c(C)c(s2)c1nc(C)c(c(n1)N)C(=O)C)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 C30H28FN7OS MW 553.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28FN7OS/c1-17-23-29(38-15-13-37(14-16-38)22-11-9-21(31)10-12-22)35-27(20-7-5-4-6-8-20)36-30(23)40-25(17)28-33-18(2)24(19(3)39)26(32)34-28/h4-12H,13-16H2,1-3H3,(H2,32,33,34)InChIKey
GPJBJMGPEJUEMQ-UHFFFAOYSA-NSynonyms
1(4amino2(4(4(4fluorophenyl)piperazin1yl)5methyl2phenylthieno(23d)pyrimidin6yl)6methylpyrimidin5yl)ethanone
CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)C4=CC=C(C=C4)F)C5=CC=CC=C5)C6=NC(=C(C(=N6)N)C(=O)C)C
InChI=1SC30H28FN7OSc1172329(38151337(141638)2211921(31)101222)3527(207546820)3630(23)4025(17)283318(2)24(19(3)39)26(32)3428h412H1316H213H3(H2323334)
MFCD03820614
ZINC000003626469
ZINC3626469
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