Vitas-M small molecule compound
2-{4-[(4-chlorobenzyl)oxy]phenyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK046092
SMILES Clc1ccc(cc1)COc1ccc(cc1)c1nc2sc3c(c2c(=O)[nH]1)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 C23H19ClN2O2S MW 422.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19ClN2O2S/c24-16-9-5-14(6-10-16)13-28-17-11-7-15(8-12-17)21-25-22(27)20-18-3-1-2-4-19(18)29-23(20)26-21/h5-12H,1-4,13H2,(H,25,26,27)InChIKey
VIBQYGNBBZEGIC-UHFFFAOYSA-NSynonyms
2(4((4chlorobenzyl)oxy)phenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(4((4chlorophenyl)methoxy)phenyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)C4=CC=C(C=C4)OCC5=CC=C(C=C5)Cl
Clc1ccc(cc1)COc1ccc(cc1)c1nc2sc3c(c2c(=O)(nH)1)CCCC3
InChI=1SC23H19ClN2O2Sc24169514(61016)13281711715(81217)212522(27)2018312419(18)2923(20)2621h512H1413H2(H252627)
MFCD03255758
STK046092
ZINC000013943036
ZINC13943036
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