Vitas-M small molecule compound
{[3-(4-ethoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetonitrile
Catalog ID
STK854255
SMILES CCOc1ccc(cc1)n1c(SCC#N)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 C20H19N3O2S2 MW 397.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O2S2/c1-2-25-14-9-7-13(8-10-14)23-19(24)17-15-5-3-4-6-16(15)27-18(17)22-20(23)26-12-11-21/h7-10H,2-6,12H2,1H3InChIKey
YEDGYOGFHHBBCQ-UHFFFAOYSA-NSynonyms
497866-63-4((3(4ethoxyphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetonitrile
2((3(4ethoxyphenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetonitrile
2((3(4ethoxyphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetonitrile
497866634
CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC#N)SC4=C3CCCC4
InChI=1SC20H19N3O2S2c1225149713(81014)2319(24)1715534616(15)2718(17)2220(23)26121121h710H2612H21H3
MFCD03301015
ZINC000002346091
ZINC02346091
ZINC2346091
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