Vitas-M small molecule compound
2-{[3-(4-ethoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(3-fluorophenyl)acetamide
Catalog ID
STK047178
SMILES CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)F)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 C26H24FN3O3S2 MW 509.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24FN3O3S2/c1-2-33-19-12-10-18(11-13-19)30-25(32)23-20-8-3-4-9-21(20)35-24(23)29-26(30)34-15-22(31)28-17-7-5-6-16(27)14-17/h5-7,10-14H,2-4,8-9,15H2,1H3,(H,28,31)InChIKey
LHOOAVDFKFBIIB-UHFFFAOYSA-NSynonyms
499125-39-22((3(4ethoxyphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N(3fluorophenyl)acetamide
2((3(4ethoxyphenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)N(3fluorophenyl)acetamide
2((3(4ethoxyphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N(3fluorophenyl)acetamide
499125392
CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)NC4=CC(=CC=C4)F)SC5=C3CCCC5
CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)F)nc2c(c1=O)c1CCCCc1s2
InChI=1SC26H24FN3O3S2c123319121018(111319)3025(32)2320834921(20)3524(23)2926(30)341522(31)281775616(27)1417h571014H248915H21H3(H2831)
MFCD03224527
STK047178
ZINC000001836467
ZINC01836467
ZINC1836467
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