Vitas-M small molecule compound
7-tert-butyl-2-{3-[4-(2,4-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL135186
SMILES Cc1ccc(c(c1)C)N1CCN(CC1)C(=O)CCc1nc2sc3c(c2c(=O)[nH]1)CCC(C3)C(C)(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 C29H38N4O2S MW 506.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H38N4O2S/c1-18-6-9-22(19(2)16-18)32-12-14-33(15-13-32)25(34)11-10-24-30-27(35)26-21-8-7-20(29(3,4)5)17-23(21)36-28(26)31-24/h6,9,16,20H,7-8,10-15,17H2,1-5H3,(H,30,31,35)InChIKey
IHNBOQNRMXYYJR-UHFFFAOYSA-NSynonyms
950444-26-57tertbutyl2(3(4(24dimethylphenyl)piperazin1yl)3oxopropyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
7tertbutyl2(3(4(24dimethylphenyl)piperazin1yl)3oxopropyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
950444265
CC1=CC(=C(C=C1)N2CCN(CC2)C(=O)CCC3=NC4=C(C5=C(S4)CC(CC5)C(C)(C)C)C(=O)N3)C
Cc1ccc(c(c1)C)N1CCN(CC1)C(=O)CCc1nc2sc3c(c2c(=O)(nH)1)CCC(C3)C(C)(C)C
InChI=1SC29H38N4O2Sc1186922(19(2)1618)32121433(151332)25(34)1110243027(35)26218720(29(34)5)1723(21)3628(26)3124h691620H78101517H215H3(H303135)
MFCD14943113
ZINC000015861436
ZINC000015861437
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