Vitas-M small molecule compound
N-(3-methoxyphenyl)-2-{[5-(4-methoxyphenyl)-8,8-dimethyl-7,10-dihydro-8H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}propanamide
Catalog ID
STK555768
SMILES COc1ccc(cc1)c1nc2CC(C)(C)OCc2c2n1c(nn2)SC(C(=O)Nc1cccc(c1)OC)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 C27H29N5O4S MW 519.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O4S/c1-16(25(33)28-18-7-6-8-20(13-18)35-5)37-26-31-30-24-21-15-36-27(2,3)14-22(21)29-23(32(24)26)17-9-11-19(34-4)12-10-17/h6-13,16H,14-15H2,1-5H3,(H,28,33)InChIKey
LTFQNUAJTYKYEV-UHFFFAOYSA-NSynonyms
843617-52-7843617527
CC(C(=O)NC1=CC(=CC=C1)OC)SC2=NN=C3N2C(=NC4=C3COC(C4)(C)C)C5=CC=C(C=C5)OC
InChI=1SC27H29N5O4Sc116(25(33)281876820(1318)355)372631302421153627(23)1422(21)2923(32(24)26)1791119(344)121017h61316H1415H215H3(H2833)
MFCD04013479
N(3methoxyphenyl)2((5(4methoxyphenyl)88dimethyl710dihydro8Hpyrano(34e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)propanamide
N(3methoxyphenyl)2((5(4methoxyphenyl)88dimethyl810dihydro7Hpyrano(34e)(124)triazolo(43c)pyrimidin3yl)thio)propanamide
ZINC000002233673
ZINC000009456281
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