Vitas-M small molecule compound
N-benzyl-2-{[3-(3-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STK113666
SMILES O=C(CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCCC3)NCc1ccccc1
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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 C26H25N3O2S2 MW 475.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O2S2/c1-17-8-7-11-19(14-17)29-25(31)23-20-12-5-6-13-21(20)33-24(23)28-26(29)32-16-22(30)27-15-18-9-3-2-4-10-18/h2-4,7-11,14H,5-6,12-13,15-16H2,1H3,(H,27,30)InChIKey
HPJQQXZYVKMMIZ-UHFFFAOYSA-NSynonyms
CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SCC(=O)NCC4=CC=CC=C4)SC5=C3CCCC5
InChI=1SC26H25N3O2S2c117871119(1417)2925(31)232012561321(20)3324(23)2826(29)321622(30)27151893241018h2471114H5612131516H21H3(H2730)
MFCD07593230
Nbenzyl2((3(3methylphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
Nbenzyl2((3(3methylphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
ZINC000009763617
ZINC09763617
ZINC9763617
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