Vitas-M small molecule compound

(2E)-N'-[2-(methylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]-3-phenylprop-2-enehydrazide

Catalog ID
STK051535
SMILES CSc1nc(NNC(=O)/C=C/c2ccccc2)c2c(n1)sc1c2CCCC1

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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 C20H20N4OS2 MW 396.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4OS2/c1-26-20-21-18(17-14-9-5-6-10-15(14)27-19(17)22-20)24-23-16(25)12-11-13-7-3-2-4-8-13/h2-4,7-8,11-12H,5-6,9-10H2,1H3,(H,23,25)(H,21,22,24)/b12-11+
InChIKey
PJZJDLKEMCSRPD-VAWYXSNFSA-N
Synonyms
351341-57-6
(2E)N(2(methylsulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4yl)3phenylprop2enehydrazide
(E)N(2methylsulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4yl)3phenylprop2enehydrazide
351341576
CSC1=NC(=C2C3=C(CCCC3)SC2=N1)NNC(=O)C=CC4=CC=CC=C4
CSc1nc(NNC(=O)C=Cc2ccccc2)c2c(n1)sc1c2CCCC1
InChI=1SC20H20N4OS2c126202118(17149561015(14)2719(17)2220)242316(25)1211137324813h24781112H56910H21H3(H2325)(H212224)b1211+
MFCD01558279
N(2(methylthio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4yl)cinnamohydrazide
STK051535
ZINC000013739541
ZINC13739541

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.