Vitas-M small molecule compound
2-[(4-tert-butylbenzyl)sulfanyl]-3-(4-chlorophenyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STL338750
SMILES Clc1ccc(cc1)n1c(SCc2ccc(cc2)C(C)(C)C)nc2c(c1=O)c1CCCc1s2
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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 C26H25ClN2OS2 MW 481.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN2OS2/c1-26(2,3)17-9-7-16(8-10-17)15-31-25-28-23-22(20-5-4-6-21(20)32-23)24(30)29(25)19-13-11-18(27)12-14-19/h7-14H,4-6,15H2,1-3H3InChIKey
DBQQDILTPFAXIS-UHFFFAOYSA-NSynonyms
613227-01-32((4(tertbutyl)benzyl)thio)3(4chlorophenyl)67dihydro3Hcyclopenta(45)thieno(23d)pyrimidin4(5H)one
2((4tertbutylbenzyl)sulfanyl)3(4chlorophenyl)3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin4one
3((4tertbutylphenyl)methylsulfanyl)2(4chlorophenyl)78dihydro6Hcyclopenta(23)thieno(24b)pyrimidin1one
613227013
CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=C(C4=C(S3)CCC4)C(=O)N2C5=CC=C(C=C5)Cl
InChI=1SC26H25ClN2OS2c126(23)179716(81017)153125282322(2054621(20)3223)24(30)29(25)19131118(27)121419h714H4615H213H3
MFCD03474554
ZINC000002508632
ZINC02508632
ZINC2508632
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