Vitas-M small molecule compound

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

Catalog ID
STL069770
SMILES COC(=O)c1ccccc1NC(=O)CSc1nc2ccccc2c(=O)n1C

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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 C19H17N3O4S MW 383.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O4S/c1-22-17(24)12-7-3-5-9-14(12)21-19(22)27-11-16(23)20-15-10-6-4-8-13(15)18(25)26-2/h3-10H,11H2,1-2H3,(H,20,23)
InChIKey
VYGOVYDEVAOTIV-UHFFFAOYSA-N
Synonyms

CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=CC=C3C(=O)OC
InChI=1SC19H17N3O4Sc12217(24)12735914(12)2119(22)271116(23)20151064813(15)18(25)262h310H11H212H3(H2023)
methyl2((((3methyl4oxo34dihydroquinazolin2yl)sulfanyl)acetyl)amino)benzoate
METHYL2((2(3METHYL4OXOQUINAZOLIN2YL)SULFANYLACETYL)AMINO)BENZOATE
MFCD05433590
ZINC000004937534
ZINC04937534
ZINC4937534

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Available files

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