Vitas-M small molecule compound
3-(4-methoxybenzyl)-2-{[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL029263
SMILES COc1ccc(cc1)Cn1c(SCC(=O)N2CCOc3c2cc(C)cc3)nc2c(c1=O)scc2
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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 C25H23N3O4S2 MW 493.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O4S2/c1-16-3-8-21-20(13-16)27(10-11-32-21)22(29)15-34-25-26-19-9-12-33-23(19)24(30)28(25)14-17-4-6-18(31-2)7-5-17/h3-9,12-13H,10-11,14-15H2,1-2H3InChIKey
QHBWIHQFZHDBKJ-UHFFFAOYSA-NSynonyms
894243-86-83((4methoxyphenyl)methyl)2(2(6methyl23dihydro14benzoxazin4yl)2oxoethyl)sulfanylthieno(32d)pyrimidin4one
3(4methoxybenzyl)2((2(6methyl23dihydro4H14benzoxazin4yl)2oxoethyl)sulfanyl)thieno(32d)pyrimidin4(3H)one
3(4METHOXYBENZYL)2((2(6METHYL2HBENZO(B)(14)OXAZIN4(3H)YL)2OXOETHYL)THIO)THIENO(32D)PYRIMIDIN4(3H)ONE
894243868
CC1=CC2=C(C=C1)OCCN2C(=O)CSC3=NC4=C(C(=O)N3CC5=CC=C(C=C5)OC)SC=C4
InChI=1SC25H23N3O4S2c116382120(1316)27(10113221)22(29)15342526199123323(19)24(30)28(25)14174618(312)7517h391213H10111415H212H3
MFCD14919876
ZINC000020561983
ZINC20561983
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