Vitas-M small molecule compound
2-({2-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK677050
SMILES O=C(N1CCN(CC1)c1nc2c(s1)cccc2)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)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 C29H27N5O2S3 MW 573.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N5O2S3/c35-24(32-14-16-33(17-15-32)28-30-21-11-5-7-13-23(21)39-28)18-37-29-31-26-25(20-10-4-6-12-22(20)38-26)27(36)34(29)19-8-2-1-3-9-19/h1-3,5,7-9,11,13H,4,6,10,12,14-18H2InChIKey
DWIRPHGVDWUMSC-UHFFFAOYSA-NSynonyms
2((2(4(13benzothiazol2yl)piperazin1yl)2oxoethyl)sulfanyl)3phenyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(2(4(13benzothiazol2yl)piperazin1yl)2oxoethyl)sulfanyl3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=CC=C4)SCC(=O)N5CCN(CC5)C6=NC7=CC=CC=C7S6
InChI=1SC29H27N5O2S3c3524(32141633(171532)28302111571323(21)3928)183729312625(2010461222(20)3826)27(36)34(29)198213919h135791113H4610121418H2
MFCD02324867
ZINC000002190078
ZINC02190078
ZINC2190078
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