Vitas-M small molecule compound

methyl 2-[({2-[benzyl(methyl)amino]-7-oxo[1,3]thiazolo[4,5-d]pyrimidin-6(7H)-yl}acetyl)amino]benzoate

Catalog ID
STL092901
SMILES COC(=O)c1ccccc1NC(=O)Cn1cnc2c(c1=O)sc(n2)N(Cc1ccccc1)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 C23H21N5O4S MW 463.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N5O4S/c1-27(12-15-8-4-3-5-9-15)23-26-20-19(33-23)21(30)28(14-24-20)13-18(29)25-17-11-7-6-10-16(17)22(31)32-2/h3-11,14H,12-13H2,1-2H3,(H,25,29)
InChIKey
MVVFZRLPXIQIMF-UHFFFAOYSA-N
Synonyms

CN(CC1=CC=CC=C1)C2=NC3=C(S2)C(=O)N(C=N3)CC(=O)NC4=CC=CC=C4C(=O)OC
InChI=1SC23H21N5O4Sc127(12158435915)23262019(3323)21(30)28(142420)1318(29)251711761016(17)22(31)322h31114H1213H212H3(H2529)
methyl2(((2(benzyl(methyl)amino)7oxo(13)thiazolo(45d)pyrimidin6(7H)yl)acetyl)amino)benzoate
methyl2((2(2(benzyl(methyl)amino)7oxo(13)thiazolo(45d)pyrimidin6yl)acetyl)amino)benzoate
MFCD18787104
ZINC000067225706
ZINC67225706

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Available files

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