Vitas-M small molecule compound

methyl 4-({[(3-amino-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetyl}amino)benzoate

Catalog ID
STL143260
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nc2ccccc2c(=O)n1N

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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 C18H16N4O4S MW 384.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O4S/c1-26-17(25)11-6-8-12(9-7-11)20-15(23)10-27-18-21-14-5-3-2-4-13(14)16(24)22(18)19/h2-9H,10,19H2,1H3,(H,20,23)
InChIKey
LSVVPDLZPJPHLY-UHFFFAOYSA-N
Synonyms
1090994-65-2
1090994652
COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2N
InChI=1SC18H16N4O4Sc12617(25)116812(9711)2015(23)1027182114532413(14)16(24)22(18)19h29H1019H21H3(H2023)
methyl4((((3amino4oxo34dihydroquinazolin2yl)sulfanyl)acetyl)amino)benzoate
methyl4((2(3amino4oxoquinazolin2yl)sulfanylacetyl)amino)benzoate
MFCD10670904
ZINC000011519269
ZINC11519269

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Available files

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