Vitas-M small molecule compound
2-{4-[(2E)-3-(2-methoxyphenyl)prop-2-enoyl]piperazin-1-yl}-3-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK641794
SMILES COc1ccccc1/C=C/C(=O)N1CCN(CC1)c1nc2sc3c(c2c(=O)n1C)CCCC3
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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 C25H28N4O3S MW 464.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N4O3S/c1-27-24(31)22-18-8-4-6-10-20(18)33-23(22)26-25(27)29-15-13-28(14-16-29)21(30)12-11-17-7-3-5-9-19(17)32-2/h3,5,7,9,11-12H,4,6,8,10,13-16H2,1-2H3/b12-11+InChIKey
IJNNZRQFAAGWNF-VAWYXSNFSA-NSynonyms
1018053-33-2(E)2(4(3(2methoxyphenyl)acryloyl)piperazin1yl)3methyl5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
1018053332
2(4((2E)3(2methoxyphenyl)prop2enoyl)piperazin1yl)3methyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(4((E)3(2methoxyphenyl)prop2enoyl)piperazin1yl)3methyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CN1C(=O)C2=C(N=C1N3CCN(CC3)C(=O)C=CC4=CC=CC=C4OC)SC5=C2CCCC5
COc1ccccc1C=CC(=O)N1CCN(CC1)c1nc2sc3c(c2c(=O)n1C)CCCC3
InChI=1SC25H28N4O3Sc12724(31)22188461020(18)3323(22)2625(27)29151328(141629)21(30)121117735919(17)322h35791112H468101316H212H3b1211+
MFCD12200514
ZINC000012323424
ZINC12323424
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