Vitas-M small molecule compound

N-(3'-acetyl-6-methoxy-3,4-dihydro-2H,3'H-spiro[naphthalene-1,2'-[1,3,4]thiadiazol]-5'-yl)acetamide

Catalog ID
STK289684
SMILES COc1ccc2c(c1)CCCC12SC(=NN1C(=O)C)NC(=O)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 C16H19N3O3S MW 333.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N3O3S/c1-10(20)17-15-18-19(11(2)21)16(23-15)8-4-5-12-9-13(22-3)6-7-14(12)16/h6-7,9H,4-5,8H2,1-3H3,(H,17,18,20)
InChIKey
ZSHGXKATSCSWPQ-UHFFFAOYSA-N
Synonyms
443105-93-9
443105939
CC(=O)NC1=NN(C2(S1)CCCC3=C2C=CC(=C3)OC)C(=O)C
InChI=1SC16H19N3O3Sc110(20)17151819(11(2)21)16(2315)84512913(223)6714(12)16h679H458H213H3(H171820)
MFCD03640230
N(3acetyl6methoxy34dihydro2H3Hspiro(naphthalene12(134)thiadiazol)5yl)acetamide
N(4acetyl7methoxyspiro(134thiadiazole5423dihydro1Hnaphthalene)2yl)acetamide
ZINC000000201326
ZINC000000201327

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Available files

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