Vitas-M small molecule compound

N-[3-(1,1-dioxido-1,2-thiazinan-2-yl)-4-methoxyphenyl]-2-(1H-tetrazol-1-yl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide

Catalog ID
STL568206
SMILES COc1ccc(cc1N1CCCCS1(=O)=O)NC(=O)c1c(sc2c1CCC2)n1cnnn1

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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 C20H22N6O4S2 MW 474.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N6O4S2/c1-30-16-8-7-13(11-15(16)26-9-2-3-10-32(26,28)29)22-19(27)18-14-5-4-6-17(14)31-20(18)25-12-21-23-24-25/h7-8,11-12H,2-6,9-10H2,1H3,(H,22,27)
InChIKey
PKSUPUDCOABJQS-UHFFFAOYSA-N
Synonyms

125432368
InChI=1SC20H22N6O4S2c130168713(1115(16)269231032(2628)29)2219(27)181454617(14)3120(18)251221232425h781112H26910H21H3(H2227)
MFCD32653329
N(3(11dioxido12thiazinan2yl)4methoxyphenyl)2(1Htetrazol1yl)56dihydro4Hcyclopenta(b)thiophene3carboxamide
N(3(11dioxothiazinan2yl)4methoxyphenyl)2(tetrazol1yl)56dihydro4Hcyclopenta(b)thiophene3carboxamide
ZINC000524733791

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Available files

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