Vitas-M small molecule compound
2-[(2-hydroxypropyl)sulfanyl]-3-phenyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK830921
SMILES CC(CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCCC3)O
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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 C20H22N2O2S2 MW 386.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O2S2/c1-13(23)12-25-20-21-18-17(15-10-6-3-7-11-16(15)26-18)19(24)22(20)14-8-4-2-5-9-14/h2,4-5,8-9,13,23H,3,6-7,10-12H2,1H3InChIKey
DNXZDNFRTBXTFH-UHFFFAOYSA-NSynonyms
2((2hydroxypropyl)sulfanyl)3phenyl356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
2((2hydroxypropyl)thio)3phenyl6789tetrahydro3Hcyclohepta(45)thieno(23d)pyrimidin4(5H)one
2(2hydroxypropylsulfanyl)3phenyl6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
CC(CSC1=NC2=C(C3=C(S2)CCCCC3)C(=O)N1C4=CC=CC=C4)O
InChI=1SC20H22N2O2S2c113(23)122520211817(15106371116(15)2618)19(24)22(20)148425914h245891323H3671012H21H3
MFCD02993688
ZINC000001135253
ZINC000001135254
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