Vitas-M small molecule compound
ethyl 4-amino-2-{4-[4-(4-fluorophenyl)piperazin-1-yl]-5-methyl-2-phenylthieno[2,3-d]pyrimidin-6-yl}-6-methylpyrimidine-5-carboxylate
Catalog ID
STK680845
SMILES CCOC(=O)c1c(C)nc(nc1N)c1sc2c(c1C)c(nc(n2)c1ccccc1)N1CCN(CC1)c1ccc(cc1)F
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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 C31H30FN7O2S MW 583.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30FN7O2S/c1-4-41-31(40)24-19(3)34-28(35-26(24)33)25-18(2)23-29(36-27(37-30(23)42-25)20-8-6-5-7-9-20)39-16-14-38(15-17-39)22-12-10-21(32)11-13-22/h5-13H,4,14-17H2,1-3H3,(H2,33,34,35)InChIKey
NTCRIOGSKKZPJH-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N=C(N=C1N)C2=C(C3=C(N=C(N=C3S2)C4=CC=CC=C4)N5CCN(CC5)C6=CC=C(C=C6)F)C)C
ethyl4amino2(4(4(4fluorophenyl)piperazin1yl)5methyl2phenylthieno(23d)pyrimidin6yl)6methylpyrimidine5carboxylate
InChI=1SC31H30FN7O2Sc144131(40)2419(3)3428(3526(24)33)2518(2)2329(3627(3730(23)4225)208657920)39161438(151739)22121021(32)111322h513H41417H213H3(H2333435)
MFCD03767439
ZINC000003624192
ZINC3624192
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