Vitas-M small molecule compound
4-(4-methoxyphenyl)-7,7-dimethyl-1-(prop-2-en-1-ylsulfanyl)-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
STK984224
SMILES C=CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)OC)CC(OC3)(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 C22H22N4O3S2 MW 454.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O3S2/c1-5-10-30-21-24-23-20-25(13-6-8-14(28-4)9-7-13)18(27)17-15-11-22(2,3)29-12-16(15)31-19(17)26(20)21/h5-9H,1,10-12H2,2-4H3InChIKey
XKYHZJFEFXWRCC-UHFFFAOYSA-NSynonyms
351385-53-01(allylthio)4(4methoxyphenyl)77dimethyl67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
351385530
4(4methoxyphenyl)77dimethyl1(prop2en1ylsulfanyl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC1(CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SCC=C)C5=CC=C(C=C5)OC)C
InChI=1SC22H22N4O3S2c1510302124232025(136814(284)9713)18(27)17151122(23)291216(15)3119(17)26(20)21h59H11012H224H3
MFCD01876547
ZINC000002271876
ZINC02271876
ZINC2271876
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