Vitas-M small molecule compound
4-({[3-(furan-2-ylmethyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Catalog ID
STL341823
SMILES N#Cc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1Cc1ccco1)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 C23H19N3O2S2 MW 433.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O2S2/c24-12-15-7-9-16(10-8-15)14-29-23-25-21-20(18-5-1-2-6-19(18)30-21)22(27)26(23)13-17-4-3-11-28-17/h3-4,7-11H,1-2,5-6,13-14H2InChIKey
ORPRKJZLXYKBAQ-UHFFFAOYSA-NSynonyms
585560-13-04(((3(furan2ylmethyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)methyl)benzonitrile
4(((3(furan2ylmethyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)methyl)benzonitrile
4((3(furan2ylmethyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanylmethyl)benzonitrile
585560130
C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)CC4=CC=CO4)SCC5=CC=C(C=C5)C#N
InChI=1SC23H19N3O2S2c2412157916(10815)142923252120(18512619(18)3021)22(27)26(23)131743112817h34711H12561314H2
MFCD04030304
ZINC000002392366
ZINC02392366
ZINC2392366
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