Vitas-M small molecule compound
4-(4-methoxyphenyl)-1-[(2-oxo-2-phenylethyl)sulfanyl]-7-(propan-2-yl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK721043
SMILES COc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CC(OCc1s2)C(C)C)SCC(=O)c1ccccc1
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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 C28H26N4O4S2 MW 546.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O4S2/c1-16(2)22-13-20-23(14-36-22)38-26-24(20)25(34)31(18-9-11-19(35-3)12-10-18)27-29-30-28(32(26)27)37-15-21(33)17-7-5-4-6-8-17/h4-12,16,22H,13-15H2,1-3H3InChIKey
MWBFSIWVOGIVRA-UHFFFAOYSA-NSynonyms
385388-04-5385388045
4(4methoxyphenyl)1((2oxo2phenylethyl)sulfanyl)7(propan2yl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
7isopropyl4(4methoxyphenyl)1((2oxo2phenylethyl)thio)67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
CC(C)C1CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SCC(=O)C5=CC=CC=C5)C6=CC=C(C=C6)OC
InChI=1SC28H26N4O4S2c116(2)22132023(143622)382624(20)25(34)31(1891119(353)121018)27293028(32(26)27)371521(33)177546817h4121622H1315H213H3
MFCD03285546
ZINC000001248822
ZINC000001248823
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