Vitas-M small molecule compound
3-[(4-amino-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[4-(hexyloxy)benzyl]propanamide
Catalog ID
STL296630
SMILES CCCCCCOc1ccc(cc1)CNC(=O)CCSc1nc(N)c2c(n1)sc1c2CC(OC1)(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 C27H36N4O3S2 MW 528.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H36N4O3S2/c1-4-5-6-7-13-33-19-10-8-18(9-11-19)16-29-22(32)12-14-35-26-30-24(28)23-20-15-27(2,3)34-17-21(20)36-25(23)31-26/h8-11H,4-7,12-17H2,1-3H3,(H,29,32)(H2,28,30,31)InChIKey
UTUGRRNDGPRGND-UHFFFAOYSA-NSynonyms
371944-29-53((4amino66dimethyl58dihydro6Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)N(4(hexyloxy)benzyl)propanamide
3((4amino66dimethyl58dihydropyrano(45)thieno(12c)pyrimidin2yl)sulfanyl)N((4hexoxyphenyl)methyl)propanamide
3((4amino66dimethyl68dihydro5Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)N(4(hexyloxy)benzyl)propanamide
371944295
CCCCCCOC1=CC=C(C=C1)CNC(=O)CCSC2=NC(=C3C4=C(COC(C4)(C)C)SC3=N2)N
InChI=1SC27H36N4O3S2c1456713331910818(91119)162922(32)121435263024(28)23201527(23)341721(20)3625(23)3126h811H471217H213H3(H2932)(H2283031)
MFCD01563085
ZINC000008951311
ZINC08951311
ZINC8951311
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