Vitas-M small molecule compound
2-({2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-3,6-dimethyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Catalog ID
STL084331
SMILES Fc1ccc(cc1)N1CCN(CC1)C(=O)CSc1nc2cc([nH]c2c(=O)n1C)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 C20H22FN5O2S MW 415.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22FN5O2S/c1-13-11-16-18(22-13)19(28)24(2)20(23-16)29-12-17(27)26-9-7-25(8-10-26)15-5-3-14(21)4-6-15/h3-6,11,22H,7-10,12H2,1-2H3InChIKey
YEHHOMYMQJYJAB-UHFFFAOYSA-NSynonyms
2((2(4(4fluorophenyl)piperazin1yl)2oxoethyl)sulfanyl)36dimethyl35dihydro4Hpyrrolo(32d)pyrimidin4one
2(2(4(4fluorophenyl)piperazin1yl)2oxoethyl)sulfanyl36dimethyl5Hpyrrolo(32d)pyrimidin4one
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)N3CCN(CC3)C4=CC=C(C=C4)F)C
Fc1ccc(cc1)N1CCN(CC1)C(=O)CSc1nc2cc((nH)c2c(=O)n1C)C
InChI=1SC20H22FN5O2Sc113111618(2213)19(28)24(2)20(2316)291217(27)269725(81026)155314(21)4615h361122H71012H212H3
MFCD18202901
ZINC000057521548
ZINC57521548
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