Vitas-M small molecule compound

methyl 2-({[(3-chlorophenyl)carbonyl]carbamothioyl}amino)benzoate

Catalog ID
STK001460
SMILES COC(=O)c1ccccc1NC(=S)NC(=O)c1cccc(c1)Cl

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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 C16H13ClN2O3S MW 348.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN2O3S/c1-22-15(21)12-7-2-3-8-13(12)18-16(23)19-14(20)10-5-4-6-11(17)9-10/h2-9H,1H3,(H2,18,19,20,23)
InChIKey
HRFFMAFUQPUPPH-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC(=CC=C2)Cl
COC(=O)c1ccccc1NC(=S)NC(=O)c1cccc(c1)Cl
InChI=1SC16H13ClN2O3Sc12215(21)12723813(12)1816(23)1914(20)1054611(17)910h29H1H3(H218192023)
METHYL2(((((3CHLOROPHENYL)CARBONYL)AMINO)CARBOTHIOYL)AMINO)BENZOATE
METHYL2((((3CHLOROPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)BENZOATE
METHYL2((3CHLOROBENZOYL)CARBAMOTHIOYLAMINO)BENZOATE
MFCD02630288
STK001460
ZINC000000361389
ZINC00361389
ZINC361389

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Available files

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