Vitas-M small molecule compound
3-(3-ethoxypropyl)-5-methyl-2-[(3-methylbenzyl)sulfanyl]-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Catalog ID
STL083826
SMILES CCOCCCn1c(SCc2cccc(c2)C)nc2c(c1=O)n(C)cc2c1ccccc1
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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 C26H29N3O2S MW 447.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O2S/c1-4-31-15-9-14-29-25(30)24-23(22(17-28(24)3)21-12-6-5-7-13-21)27-26(29)32-18-20-11-8-10-19(2)16-20/h5-8,10-13,16-17H,4,9,14-15,18H2,1-3H3InChIKey
VXDJISYOPBAVNF-UHFFFAOYSA-NSynonyms
3(3ethoxypropyl)5methyl2((3methylbenzyl)sulfanyl)7phenyl35dihydro4Hpyrrolo(32d)pyrimidin4one
3(3ethoxypropyl)5methyl2((3methylphenyl)methylsulfanyl)7phenylpyrrolo(32d)pyrimidin4one
CCOCCCN1C(=O)C2=C(C(=CN2C)C3=CC=CC=C3)N=C1SCC4=CC=CC(=C4)C
InChI=1SC26H29N3O2Sc1431159142925(30)2423(22(1728(24)3)21126571321)2726(29)3218201181019(2)1620h5810131617H49141518H213H3
MFCD18202495
ZINC000057519928
ZINC57519928
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