Vitas-M small molecule compound

propyl 4-[({[4-(propan-2-yl)phenyl]carbonyl}carbamothioyl)amino]benzoate

Catalog ID
STK148414
SMILES CCCOC(=O)c1ccc(cc1)NC(=S)NC(=O)c1ccc(cc1)C(C)C

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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 C21H24N2O3S MW 384.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O3S/c1-4-13-26-20(25)17-9-11-18(12-10-17)22-21(27)23-19(24)16-7-5-15(6-8-16)14(2)3/h5-12,14H,4,13H2,1-3H3,(H2,22,23,24,27)
InChIKey
VNUDMQZKFXJALS-UHFFFAOYSA-N
Synonyms

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C(C)C
InChI=1SC21H24N2O3Sc14132620(25)1791118(121017)2221(27)2319(24)167515(6816)14(2)3h51214H413H213H3(H222232427)
MFCD03137198
PROPYL4((((4(PROPAN2YL)PHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)BENZOATE
PROPYL4((4PROPAN2YLBENZOYL)CARBAMOTHIOYLAMINO)BENZOATE
ZINC000004687326
ZINC04687326
ZINC4687326

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Available files

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