Vitas-M small molecule compound
3-{[4-oxo-3-(prop-2-en-1-yl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(4-propoxybenzyl)propanamide
Catalog ID
STL296623
SMILES CCCOc1ccc(cc1)CNC(=O)CCSc1nc2sc3c(c2c(=O)n1CC=C)CCC3
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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 C25H29N3O3S2 MW 483.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3O3S2/c1-3-13-28-24(30)22-19-6-5-7-20(19)33-23(22)27-25(28)32-15-12-21(29)26-16-17-8-10-18(11-9-17)31-14-4-2/h3,8-11H,1,4-7,12-16H2,2H3,(H,26,29)InChIKey
NRMREIXTDZXGJW-UHFFFAOYSA-NSynonyms
371205-34-43((1oxo2prop2enyl78dihydro6Hcyclopenta(23)thieno(24b)pyrimidin3yl)sulfanyl)N((4propoxyphenyl)methyl)propanamide
3((3allyl4oxo4567tetrahydro3Hcyclopenta(45)thieno(23d)pyrimidin2yl)thio)N(4propoxybenzyl)propanamide
3((4oxo3(prop2en1yl)3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin2yl)sulfanyl)N(4propoxybenzyl)propanamide
371205344
CCCOC1=CC=C(C=C1)CNC(=O)CCSC2=NC3=C(C4=C(S3)CCC4)C(=O)N2CC=C
InChI=1SC25H29N3O3S2c13132824(30)221965720(19)3323(22)2725(28)32151221(29)26161781018(11917)311442h3811H1471216H22H3(H2629)
MFCD01565442
ZINC000009034179
ZINC09034179
ZINC9034179
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