Vitas-M small molecule compound

N-(1,3-benzothiazol-2-yl)-2-{[3-(2-methylpropyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetamide

Catalog ID
STL014707
SMILES O=C(Nc1nc2c(s1)cccc2)CSc1nc2ccccc2c(=O)n1CC(C)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 C21H20N4O2S2 MW 424.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O2S2/c1-13(2)11-25-19(27)14-7-3-4-8-15(14)23-21(25)28-12-18(26)24-20-22-16-9-5-6-10-17(16)29-20/h3-10,13H,11-12H2,1-2H3,(H,22,24,26)
InChIKey
NJJAIVXBCAOUNG-UHFFFAOYSA-N
Synonyms

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=NC4=CC=CC=C4S3
InChI=1SC21H20N4O2S2c113(2)112519(27)14734815(14)2321(25)281218(26)242022169561017(16)2920h31013H1112H212H3(H222426)
MFCD18186633
N(13benzothiazol2yl)2((3(2methylpropyl)4oxo34dihydroquinazolin2yl)sulfanyl)acetamide
N(13benzothiazol2yl)2(3(2methylpropyl)4oxoquinazolin2yl)sulfanylacetamide
ZINC000051357487
ZINC51357487

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Available files

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