Vitas-M small molecule compound
3-(4-chlorophenyl)-1-(2,5-dimethylbenzyl)[1]benzothieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Catalog ID
STL135036
SMILES Clc1ccc(cc1)n1c(=O)n(Cc2cc(C)ccc2C)c2c(c1=O)sc1c2cccc1
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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 C25H19ClN2O2S MW 446.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19ClN2O2S/c1-15-7-8-16(2)17(13-15)14-27-22-20-5-3-4-6-21(20)31-23(22)24(29)28(25(27)30)19-11-9-18(26)10-12-19/h3-13H,14H2,1-2H3InChIKey
OKLQZMLRDZUQHO-UHFFFAOYSA-NSynonyms
3(4chlorophenyl)1((25dimethylphenyl)methyl)(1)benzothiolo(32d)pyrimidine24dione
3(4chlorophenyl)1(25dimethylbenzyl)(1)benzothieno(32d)pyrimidine24(1H3H)dione
CC1=CC(=C(C=C1)C)CN2C3=C(C(=O)N(C2=O)C4=CC=C(C=C4)Cl)SC5=CC=CC=C53
InChI=1SC25H19ClN2O2Sc1157816(2)17(1315)14272220534621(20)3123(22)24(29)28(25(27)30)1911918(26)101219h313H14H212H3
MFCD14782974
ZINC000009959483
ZINC9959483
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