Vitas-M small molecule compound

methyl 3-amino-4-oxo-2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-3,4-dihydroquinazoline-7-carboxylate

Catalog ID
STL166893
SMILES COC(=O)c1ccc2c(c1)nc(n(c2=O)N)SCc1cc(=O)n2c(n1)cccc2

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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 C19H15N5O4S MW 409.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N5O4S/c1-28-18(27)11-5-6-13-14(8-11)22-19(24(20)17(13)26)29-10-12-9-16(25)23-7-3-2-4-15(23)21-12/h2-9H,10,20H2,1H3
InChIKey
YFWPOBALPPPBTA-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC(=O)N4C=CC=CC4=N3)N
InChI=1SC19H15N5O4Sc12818(27)11561314(811)2219(24(20)17(13)26)291012916(25)23732415(23)2112h29H1020H21H3
methyl3amino4oxo2(((4oxo4Hpyrido(12a)pyrimidin2yl)methyl)sulfanyl)34dihydroquinazoline7carboxylate
methyl3amino4oxo2((4oxopyrido(12a)pyrimidin2yl)methylsulfanyl)quinazoline7carboxylate
MFCD20749091
ZINC000071768720
ZINC71768720

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.