Vitas-M small molecule compound
3-(3,4-dimethylbenzyl)-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL029773
SMILES O=C(N1CCCCC1)CSc1nc2ccsc2c(=O)n1Cc1ccc(c(c1)C)C
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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 C22H25N3O2S2 MW 427.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O2S2/c1-15-6-7-17(12-16(15)2)13-25-21(27)20-18(8-11-28-20)23-22(25)29-14-19(26)24-9-4-3-5-10-24/h6-8,11-12H,3-5,9-10,13-14H2,1-2H3InChIKey
VVUSGHYTIFCPIW-UHFFFAOYSA-NSynonyms
3((34dimethylphenyl)methyl)2(2oxo2piperidin1ylethyl)sulfanylthieno(32d)pyrimidin4one
3(34dimethylbenzyl)2((2oxo2(piperidin1yl)ethyl)sulfanyl)thieno(32d)pyrimidin4(3H)one
CC1=C(C=C(C=C1)CN2C(=O)C3=C(C=CS3)N=C2SCC(=O)N4CCCCC4)C
InChI=1SC22H25N3O2S2c1156717(1216(15)2)132521(27)2018(8112820)2322(25)291419(26)2494351024h681112H359101314H212H3
MFCD18190063
ZINC000057426357
ZINC57426357
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