Vitas-M small molecule compound

barium bis{4-[(4-sulfamoylphenyl)amino]butanoate}

Catalog ID
STK367240
SMILES O=C(O[Ba]OC(=O)CCCNc1ccc(cc1)S(=O)(=O)N)CCCNc1ccc(cc1)S(=O)(=O)N

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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 C20H26BaN4O8S2 MW 651.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/2C10H14N2O4S.Ba/c2*11-17(15,16)9-5-3-8(4-6-9)12-7-1-2-10(13)14;/h2*3-6,12H,1-2,7H2,(H,13,14)(H2,11,15,16);/q;;+2/p-2
InChIKey
ZRYPJAOIGGNWHN-UHFFFAOYSA-L
Synonyms

BARIUM(2)4(4SULFAMOYLANILINO)BUTANOATE
barium(2+)4(4sulfamoylanilino)butanoate
bariumbis(4((4sulfamoylphenyl)amino)butanoate)
C1=CC(=CC=C1NCCCC(=O)(O))S(=O)(=O)NC1=CC(=CC=C1NCCCC(=O)(O))S(=O)(=O)N(Ba+2)
InChI=1S2C10H14N2O4SBac2*1117(1516)9538(469)1271210(13)14h2*3612H127H2(H1314)(H2111516)q+2p2
MFCD00328397
O=C(O(Ba)OC(=O)CCCNc1ccc(cc1)S(=O)(=O)N)CCCNc1ccc(cc1)S(=O)(=O)N

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Available files

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