Vitas-M small molecule compound
1-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-3-(3,5-dimethylphenyl)thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Catalog ID
STL077888
SMILES Cc1cc(C)cc(c1)n1c(=O)n(CC(=O)N2CCN(CC2)Cc2ccccc2)c2c(c1=O)scc2
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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/c1-19-14-20(2)16-22(15-19)31-26(33)25-23(8-13-35-25)30(27(31)34)18-24(32)29-11-9-28(10-12-29)17-21-6-4-3-5-7-21/h3-8,13-16H,9-12,17-18H2,1-2H3InChIKey
GJHZYUMRLRSNAB-UHFFFAOYSA-NSynonyms
1(2(4benzylpiperazin1yl)2oxoethyl)3(35dimethylphenyl)thieno(32d)pyrimidine24(1H3H)dione
1(2(4benzylpiperazin1yl)2oxoethyl)3(35dimethylphenyl)thieno(32d)pyrimidine24dione
CC1=CC(=CC(=C1)N2C(=O)C3=C(C=CS3)N(C2=O)CC(=O)N4CCN(CC4)CC5=CC=CC=C5)C
InChI=1SC27H28N4O3Sc1191420(2)1622(1519)3126(33)2523(8133525)30(27(31)34)1824(32)2911928(101229)17216435721h381316H9121718H212H3
MFCD18199098
ZINC000067218218
ZINC67218218
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