Vitas-M small molecule compound
3-(3-methylphenyl)-2-[(3-phenylpropyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK107805
SMILES Cc1cccc(c1)n1c(SCCCc2ccccc2)nc2c(c1=O)c1CCCCc1s2
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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 C26H26N2OS2 MW 446.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2OS2/c1-18-9-7-13-20(17-18)28-25(29)23-21-14-5-6-15-22(21)31-24(23)27-26(28)30-16-8-12-19-10-3-2-4-11-19/h2-4,7,9-11,13,17H,5-6,8,12,14-16H2,1H3InChIKey
BPYRIMTXORPXFV-UHFFFAOYSA-NSynonyms
3(3methylphenyl)2((3phenylpropyl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(3methylphenyl)2(3phenylpropylsulfanyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SCCCC4=CC=CC=C4)SC5=C3CCCC5
InChI=1SC26H26N2OS2c118971320(1718)2825(29)232114561522(21)3124(23)2726(28)301681219103241119h2479111317H568121416H21H3
MFCD05150074
ZINC000009296215
ZINC09296215
ZINC9296215
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