Vitas-M small molecule compound
5,5'-{[3-bromo-4-(butan-2-yloxy)-5-ethoxyphenyl]methanediyl}bis(1,3-dimethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione)
Catalog ID
STK189632
SMILES CCOc1cc(cc(c1OC(CC)C)Br)C(C1C(=O)N(C)C(=S)N(C1=O)C)C1C(=O)N(C)C(=S)N(C1=O)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 C25H31BrN4O6S2 MW 627.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31BrN4O6S2/c1-8-12(3)36-19-14(26)10-13(11-15(19)35-9-2)16(17-20(31)27(4)24(37)28(5)21(17)32)18-22(33)29(6)25(38)30(7)23(18)34/h10-12,16-18H,8-9H2,1-7H3InChIKey
DPFYLHRGPKRCQM-UHFFFAOYSA-NSynonyms
5((3BROMO4BUTAN2YLOXY5ETHOXYPHENYL)(13DIMETHYL46DIOXO2SULFANYLIDENE13DIAZINAN5YL)METHYL)13DIMETHYL2SULFANYLIDENE13DIAZINANE46DIONE
55((3BROMO4(BUTAN2YLOXY)5ETHOXYPHENYL)METHANEDIYL)BIS(13DIMETHYL2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE)
CCC(C)OC1=C(C=C(C=C1Br)C(C2C(=O)N(C(=S)N(C2=O)C)C)C3C(=O)N(C(=S)N(C3=O)C)C)OCC
InChI=1SC25H31BrN4O6S2c1812(3)361914(26)1013(1115(19)3592)16(1720(31)27(4)24(37)28(5)21(17)32)1822(33)29(6)25(38)30(7)23(18)34h10121618H89H217H3
MFCD06666126
ZINC000100389029
ZINC000100389033
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