Vitas-M small molecule compound
N-(4-acetylphenyl)-2-{[3-(4-ethoxyphenyl)-6,6-dimethyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STK557679
SMILES CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)C)nc2c(c1=O)c1CC(C)(C)OCc1s2
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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 C29H29N3O5S2 MW 563.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O5S2/c1-5-36-21-12-10-20(11-13-21)32-27(35)25-22-14-29(3,4)37-15-23(22)39-26(25)31-28(32)38-16-24(34)30-19-8-6-18(7-9-19)17(2)33/h6-13H,5,14-16H2,1-4H3,(H,30,34)InChIKey
BHLVVOWTIUABLJ-UHFFFAOYSA-NSynonyms
CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)NC4=CC=C(C=C4)C(=O)C)SC5=C3CC(OC5)(C)C
InChI=1SC29H29N3O5S2c153621121020(111321)3227(35)25221429(34)371523(22)3926(25)3128(32)381624(34)30198618(7919)17(2)33h613H51416H214H3(H3034)
MFCD04027076
N(4acetylphenyl)2((3(4ethoxyphenyl)66dimethyl4oxo3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(4acetylphenyl)2((3(4ethoxyphenyl)66dimethyl4oxo4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)acetamide
N(4acetylphenyl)2((3(4ethoxyphenyl)66dimethyl4oxo58dihydropyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)acetamide
ZINC000001758365
ZINC01758365
ZINC1758365
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