Vitas-M small molecule compound
N-(4-fluorophenyl)-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
STK113428
SMILES O=C(Nc1ccc(cc1)F)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)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 C25H22FN3O2S2 MW 479.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22FN3O2S2/c1-15-5-4-6-18(13-15)29-24(31)22-19-7-2-3-8-20(19)33-23(22)28-25(29)32-14-21(30)27-17-11-9-16(26)10-12-17/h4-6,9-13H,2-3,7-8,14H2,1H3,(H,27,30)InChIKey
MKLYHDYGYHRJDG-UHFFFAOYSA-NSynonyms
CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SCC(=O)NC4=CC=C(C=C4)F)SC5=C3CCCC5
InChI=1SC25H22FN3O2S2c11554618(1315)2924(31)2219723820(19)3323(22)2825(29)321421(30)271711916(26)101217h46913H237814H21H3(H2730)
MFCD07593229
N(4fluorophenyl)2((3(3methylphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(4fluorophenyl)2((3(3methylphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
ZINC000009763586
ZINC09763586
ZINC9763586
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