Vitas-M small molecule compound
4-(4-hydroxy-7-methyl-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)phenyl naphthalene-1-carboxylate
Catalog ID
STK384841
SMILES CC1CCc2c(C1)sc1c2C(=NC(N1)c1ccc(cc1)OC(=O)c1cccc2c1cccc2)O
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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 C28H24N2O3S MW 468.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N2O3S/c1-16-9-14-22-23(15-16)34-27-24(22)26(31)29-25(30-27)18-10-12-19(13-11-18)33-28(32)21-8-4-6-17-5-2-3-7-20(17)21/h2-8,10-13,16,25,30H,9,14-15H2,1H3,(H,29,31)InChIKey
VQLLWOCKPOYQRC-UHFFFAOYSA-NSynonyms
(4(7methyl4oxo235678hexahydro1H(1)benzothiolo(23d)pyrimidin2yl)phenyl)naphthalene1carboxylate
4(4hydroxy7methyl125678hexahydro(1)benzothieno(23d)pyrimidin2yl)phenylnaphthalene1carboxylate
CC1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC=C(C=C4)OC(=O)C5=CC=CC6=CC=CC=C65
InChI=1SC28H24N2O3Sc1169142223(1516)342724(22)26(31)2925(3027)18101219(131118)3328(32)2184617523720(17)21h281013162530H91415H21H3(H2931)
MFCD11853305
ZINC000015947599
ZINC000015947604
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