Vitas-M small molecule compound
2-(3-iodo-4,5-dimethoxyphenyl)-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STK541199
SMILES COc1cc(cc(c1OC)I)C1NC(=O)c2c(N1)sc1c2CCCC1
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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 C18H19IN2O3S MW 470.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19IN2O3S/c1-23-12-8-9(7-11(19)15(12)24-2)16-20-17(22)14-10-5-3-4-6-13(10)25-18(14)21-16/h7-8,16,21H,3-6H2,1-2H3,(H,20,22)InChIKey
WCBPHIYAMBVQFV-UHFFFAOYSA-NSynonyms
328910-80-12(3iodo45dimethoxyphenyl)235678hexahydro(1)benzothieno(23d)pyrimidin4(1H)one
2(3iodo45dimethoxyphenyl)235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
2(3iodo45dimethoxyphenyl)235678hexahydrobenzo(45)thieno(23d)pyrimidin4(1H)one
328910801
COC1=C(C(=CC(=C1)C2NC3=C(C4=C(S3)CCCC4)C(=O)N2)I)OC
InChI=1SC18H19IN2O3Sc1231289(711(19)15(12)242)162017(22)1410534613(10)2518(14)2116h781621H36H212H3(H2022)
MFCD01065135
ZINC000000989530
ZINC000000989531
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