Vitas-M small molecule compound
4-(4-methoxyphenyl)-1-[(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
STK540573
SMILES COc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CC(OCc1s2)C(C)C)SCCc1ccccc1
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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 C28H28N4O3S2 MW 532.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O3S2/c1-17(2)22-15-21-23(16-35-22)37-26-24(21)25(33)31(19-9-11-20(34-3)12-10-19)27-29-30-28(32(26)27)36-14-13-18-7-5-4-6-8-18/h4-12,17,22H,13-16H2,1-3H3InChIKey
HQBVJZZVJFNXNB-UHFFFAOYSA-NSynonyms
384349-82-0384349820
4(4methoxyphenyl)1((2phenylethyl)sulfanyl)7(propan2yl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
7isopropyl4(4methoxyphenyl)1(phenethylthio)67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
CC(C)C1CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SCCC5=CC=CC=C5)C6=CC=C(C=C6)OC
InChI=1SC28H28N4O3S2c117(2)22152123(163522)372624(21)25(33)31(1991120(343)121019)27293028(32(26)27)361413187546818h4121722H1316H213H3
MFCD03285170
ZINC000001867674
ZINC000001867675
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