Vitas-M small molecule compound
1-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-3-(3,4-dimethylphenyl)thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Catalog ID
STL077505
SMILES O=C(N1CCN(CC1)Cc1ccccc1)Cn1c2ccsc2c(=O)n(c1=O)c1ccc(c(c1)C)C
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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 C27H28N4O3S MW 488.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O3S/c1-19-8-9-22(16-20(19)2)31-26(33)25-23(10-15-35-25)30(27(31)34)18-24(32)29-13-11-28(12-14-29)17-21-6-4-3-5-7-21/h3-10,15-16H,11-14,17-18H2,1-2H3InChIKey
QLXJYUZBAZIPTB-UHFFFAOYSA-NSynonyms
1(2(4benzylpiperazin1yl)2oxoethyl)3(34dimethylphenyl)thieno(32d)pyrimidine24(1H3H)dione
1(2(4benzylpiperazin1yl)2oxoethyl)3(34dimethylphenyl)thieno(32d)pyrimidine24dione
CC1=C(C=C(C=C1)N2C(=O)C3=C(C=CS3)N(C2=O)CC(=O)N4CCN(CC4)CC5=CC=CC=C5)C
InChI=1SC27H28N4O3Sc1198922(1620(19)2)3126(33)2523(10153525)30(27(31)34)1824(32)29131128(121429)17216435721h3101516H11141718H212H3
MFCD18198732
ZINC000067218012
ZINC67218012
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