Vitas-M small molecule compound
3-methyl-2-{4-[(2-nitrophenyl)carbonyl]piperazin-1-yl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK639789
SMILES [O-][N+](=O)c1ccccc1C(=O)N1CCN(CC1)c1nc2sc3c(c2c(=O)n1C)CCCC3
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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 C22H23N5O4S MW 453.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O4S/c1-24-21(29)18-15-7-3-5-9-17(15)32-19(18)23-22(24)26-12-10-25(11-13-26)20(28)14-6-2-4-8-16(14)27(30)31/h2,4,6,8H,3,5,7,9-13H2,1H3InChIKey
MEVKNABVLVXUNP-UHFFFAOYSA-NSynonyms
951972-45-5(O)(N+)(=O)c1ccccc1C(=O)N1CCN(CC1)c1nc2sc3c(c2c(=O)n1C)CCCC3
3methyl2(4((2nitrophenyl)carbonyl)piperazin1yl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3methyl2(4(2nitrobenzoyl)piperazin1yl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
3methyl2(4(2nitrobenzoyl)piperazin1yl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
CN1C(=O)C2=C(N=C1N3CCN(CC3)C(=O)C4=CC=CC=C4(N+)(=O)(O))SC5=C2CCCC5
Registry IDs
MFCD09850626ZINC000013688132
ZINC13688132
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