Vitas-M small molecule compound

propyl 4-({[(3-propoxyphenyl)carbonyl]carbamothioyl}amino)benzoate

Catalog ID
STK030238
SMILES CCCOc1cccc(c1)C(=O)NC(=S)Nc1ccc(cc1)C(=O)OCCC

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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 C21H24N2O4S MW 400.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O4S/c1-3-12-26-18-7-5-6-16(14-18)19(24)23-21(28)22-17-10-8-15(9-11-17)20(25)27-13-4-2/h5-11,14H,3-4,12-13H2,1-2H3,(H2,22,23,24,28)
InChIKey
FNPGOMPNJDFOGO-UHFFFAOYSA-N
Synonyms

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)OCCC
CCCOc1cccc(c1)C(=O)NC(=S)Nc1ccc(cc1)C(=O)OCCC
InChI=1SC21H24N2O4Sc1312261875616(1418)19(24)2321(28)221710815(91117)20(25)271342h51114H341213H212H3(H222232428)
MFCD02630289
PROPYL4((((3PROPOXYPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)BENZOATE
PROPYL4((3PROPOXYBENZOYL)CARBAMOTHIOYLAMINO)BENZOATE
STK030238
ZINC000002986969
ZINC02986969
ZINC2986969

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Available files

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