Vitas-M small molecule compound
2-(3-cyclohexyl-6,6-dimethyl-2,4-dioxo-3,4,5,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-1(6H)-yl)-N-(3-methoxyphenyl)acetamide
Catalog ID
STL448163
SMILES COc1cccc(c1)NC(=O)Cn1c(=O)n(C2CCCCC2)c(=O)c2c1sc1c2CC(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 C26H31N3O5S MW 497.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N3O5S/c1-26(2)13-19-20(15-34-26)35-24-22(19)23(31)29(17-9-5-4-6-10-17)25(32)28(24)14-21(30)27-16-8-7-11-18(12-16)33-3/h7-8,11-12,17H,4-6,9-10,13-15H2,1-3H3,(H,27,30)InChIKey
VTIOLXXZZPTTGZ-UHFFFAOYSA-NSynonyms
2(3cyclohexyl66dimethyl24dioxo3458tetrahydro2Hpyrano(4345)thieno(23d)pyrimidin1(6H)yl)N(3methoxyphenyl)acetamide
2(3cyclohexyl66dimethyl24dioxo58dihydropyrano(23)thieno(24b)pyrimidin1yl)N(3methoxyphenyl)acetamide
CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=O)N3CC(=O)NC4=CC(=CC=C4)OC)C5CCCCC5)C
InChI=1SC26H31N3O5Sc126(2)131920(153426)352422(19)23(31)29(1795461017)25(32)28(24)1421(30)2716871118(1216)333h78111217H469101315H213H3(H2730)
MFCD07773644
ZINC000008769953
ZINC8769953
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