Vitas-M small molecule compound
3-(4-methoxyphenyl)-2-[(3-methylbutyl)sulfanyl]-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK722348
SMILES COc1ccc(cc1)n1c(SCCC(C)C)nc2c(c1=O)c1CCCCCc1s2
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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 C23H28N2O2S2 MW 428.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2O2S2/c1-15(2)13-14-28-23-24-21-20(18-7-5-4-6-8-19(18)29-21)22(26)25(23)16-9-11-17(27-3)12-10-16/h9-12,15H,4-8,13-14H2,1-3H3InChIKey
WEWHRXXMDPHTKK-UHFFFAOYSA-NSynonyms
351160-99-12(isopentylthio)3(4methoxyphenyl)6789tetrahydro3Hcyclohepta(45)thieno(23d)pyrimidin4(5H)one
3(4methoxyphenyl)2((3methylbutyl)sulfanyl)356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
3(4methoxyphenyl)2(3methylbutylsulfanyl)6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
351160991
CC(C)CCSC1=NC2=C(C3=C(S2)CCCCC3)C(=O)N1C4=CC=C(C=C4)OC
InChI=1SC23H28N2O2S2c115(2)13142823242120(187546819(18)2921)22(26)25(23)1691117(273)121016h91215H481314H213H3
MFCD01878473
ZINC000002274477
ZINC02274477
ZINC2274477
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