Vitas-M small molecule compound
1-[(4-methoxybenzyl)sulfanyl]-4-(2-phenylethyl)-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
STK544572
SMILES COc1ccc(cc1)CSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CC(OC3)C(C)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 C29H30N4O3S2 MW 546.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N4O3S2/c1-18(2)23-15-22-24(16-36-23)38-27-25(22)26(34)32(14-13-19-7-5-4-6-8-19)28-30-31-29(33(27)28)37-17-20-9-11-21(35-3)12-10-20/h4-12,18,23H,13-17H2,1-3H3InChIKey
OLBAALXQBMWLGU-UHFFFAOYSA-NSynonyms
499208-61-61((4methoxybenzyl)sulfanyl)4(2phenylethyl)7(propan2yl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
499208616
7isopropyl1((4methoxybenzyl)thio)4phenethyl67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
CC(C)C1CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SCC5=CC=C(C=C5)OC)CCC6=CC=CC=C6
InChI=1SC29H30N4O3S2c118(2)23152224(163623)382725(22)26(34)32(1413197546819)28303129(33(27)28)37172091121(353)121020h4121823H1317H213H3
MFCD03303550
ZINC000001832251
ZINC000001832252
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