Vitas-M small molecule compound

4-methoxy-3-({[(3,4,5-triethoxyphenyl)carbonyl]carbamothioyl}amino)benzoic acid

Catalog ID
STL355680
SMILES CCOc1cc(cc(c1OCC)OCC)C(=O)NC(=S)Nc1cc(ccc1OC)C(=O)O

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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 C22H26N2O7S MW 462.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O7S/c1-5-29-17-11-14(12-18(30-6-2)19(17)31-7-3)20(25)24-22(32)23-15-10-13(21(26)27)8-9-16(15)28-4/h8-12H,5-7H2,1-4H3,(H,26,27)(H2,23,24,25,32)
InChIKey
FDQXQBLMBGDVMR-UHFFFAOYSA-N
Synonyms
435291-29-5
435291295
4methoxy3((((345triethoxyphenyl)carbonyl)carbamothioyl)amino)benzoicacid
4METHOXY3((345TRIETHOXYBENZOYL)CARBAMOTHIOYLAMINO)BENZOICACID
4methoxy3(3(345triethoxybenzoyl)thioureido)benzoicacid
CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=C(C=CC(=C2)C(=O)O)OC
InChI=1SC22H26N2O7Sc1529171114(1218(3062)19(17)3173)20(25)2422(32)23151013(21(26)27)8916(15)284h812H57H214H3(H2627)(H223242532)
MFCD03563750
ZINC000009427773
ZINC9427773

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Available files

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