Vitas-M small molecule compound

1-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(3-fluorobenzyl)-6-oxo-1,4,5,6-tetrahydropyridazine-3-carboxamide

Catalog ID
STL161900
SMILES Fc1cccc(c1)CNC(=O)C1=NN(C(=O)CC1)C1CCS(=O)(=O)C1

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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 C16H18FN3O4S MW 367.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18FN3O4S/c17-12-3-1-2-11(8-12)9-18-16(22)14-4-5-15(21)20(19-14)13-6-7-25(23,24)10-13/h1-3,8,13H,4-7,9-10H2,(H,18,22)
InChIKey
FQWHXZYVLBAGBM-UHFFFAOYSA-N
Synonyms
1324079-14-2
1(11dioxidotetrahydrothiophen3yl)N(3fluorobenzyl)6oxo1456tetrahydropyridazine3carboxamide
1(11dioxothiolan3yl)N((3fluorophenyl)methyl)6oxo45dihydropyridazine3carboxamide
1324079142
C1CS(=O)(=O)CC1N2C(=O)CCC(=N2)C(=O)NCC3=CC(=CC=C3)F
InChI=1SC16H18FN3O4Sc171231211(812)91816(22)144515(21)20(1914)136725(2324)1013h13813H47910H2(H1822)
MFCD19710132
ZINC000071283124
ZINC000071283125

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Available files

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