Vitas-M small molecule compound
7,7-dimethyl-4-(2-phenylethyl)-1-{[4-(propan-2-yloxy)benzyl]sulfanyl}-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
STK937923
SMILES CC(Oc1ccc(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 C30H32N4O3S2 MW 560.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N4O3S2/c1-19(2)37-22-12-10-21(11-13-22)18-38-29-32-31-28-33(15-14-20-8-6-5-7-9-20)26(35)25-23-16-30(3,4)36-17-24(23)39-27(25)34(28)29/h5-13,19H,14-18H2,1-4H3InChIKey
YCDIDJJHVXQXQB-UHFFFAOYSA-NSynonyms
1((4isopropoxybenzyl)thio)77dimethyl4phenethyl67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
77dimethyl4(2phenylethyl)1((4(propan2yloxy)benzyl)sulfanyl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC(C)OC1=CC=C(C=C1)CSC2=NN=C3N2C4=C(C5=C(S4)COC(C5)(C)C)C(=O)N3CCC6=CC=CC=C6
InChI=1SC30H32N4O3S2c119(2)3722121021(111322)18382932312833(1514208657920)26(35)25231630(34)361724(23)3927(25)34(28)29h51319H1418H214H3
MFCD03292250
ZINC000001809481
ZINC01809481
ZINC1809481
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