Vitas-M small molecule compound
3-(4-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK541005
SMILES CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)c1ccc(cc1)C)SC(C(=O)N1CCCCC1)C)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 C27H33N3O3S2 MW 511.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33N3O3S2/c1-16(2)21-14-20-22(15-33-21)35-24-23(20)26(32)30(19-10-8-17(3)9-11-19)27(28-24)34-18(4)25(31)29-12-6-5-7-13-29/h8-11,16,18,21H,5-7,12-15H2,1-4H3InChIKey
YKOMFTOHQWNRRE-UHFFFAOYSA-NSynonyms
371211-57-33(4methylphenyl)2((1oxo1(piperidin1yl)propan2yl)sulfanyl)6(propan2yl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
3(4methylphenyl)2(1oxo1piperidin1ylpropan2yl)sulfanyl6propan2yl68dihydro5Hpyrano(23)thieno(24b)pyrimidin4one
371211573
6isopropyl2((1oxo1(piperidin1yl)propan2yl)thio)3(ptolyl)56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SC(C)C(=O)N4CCCCC4)SC5=C3CC(OC5)C(C)C
InChI=1SC27H33N3O3S2c116(2)21142022(153321)352423(20)26(32)30(1910817(3)91119)27(2824)3418(4)25(31)29126571329h811161821H571215H214H3
MFCD03009935
ZINC000002315661
ZINC000002315664
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