Vitas-M small molecule compound
1-(benzylsulfanyl)-4-(4-methoxyphenyl)-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
STK840334
SMILES COc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CC(OCc1s2)C(C)C)SCc1ccccc1
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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 C27H26N4O3S2 MW 518.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O3S2/c1-16(2)21-13-20-22(14-34-21)36-25-23(20)24(32)30(18-9-11-19(33-3)12-10-18)26-28-29-27(31(25)26)35-15-17-7-5-4-6-8-17/h4-12,16,21H,13-15H2,1-3H3InChIKey
GOEPNMIRUXAAPL-UHFFFAOYSA-NSynonyms
385389-31-11(benzylsulfanyl)4(4methoxyphenyl)7(propan2yl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1(benzylthio)7isopropyl4(4methoxyphenyl)67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
385389311
CC(C)C1CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SCC5=CC=CC=C5)C6=CC=C(C=C6)OC
InChI=1SC27H26N4O3S2c116(2)21132022(143421)362523(20)24(32)30(1891119(333)121018)26282927(31(25)26)3515177546817h4121621H1315H213H3
MFCD03285623
ZINC000001834310
ZINC000001834311
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