Vitas-M small molecule compound

methyl 2-{[(E)-(4-oxo-3-phenyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]amino}benzoate

Catalog ID
STK719337
SMILES COC(=O)c1ccccc1N/C=C\1/SC(=S)N(C1=O)c1ccccc1

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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 C18H14N2O3S2 MW 370.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O3S2/c1-23-17(22)13-9-5-6-10-14(13)19-11-15-16(21)20(18(24)25-15)12-7-3-2-4-8-12/h2-11,19H,1H3/b15-11+
InChIKey
YLVDTCDLBHBJON-RVDMUPIBSA-N
Synonyms

(E)methyl2(((4oxo3phenyl2thioxothiazolidin5ylidene)methyl)amino)benzoate
COC(=O)C1=CC=CC=C1NC=C2C(=O)N(C(=S)S2)C3=CC=CC=C3
COC(=O)c1ccccc1NC=C1SC(=S)N(C1=O)c1ccccc1
InChI=1SC18H14N2O3S2c12317(22)139561014(13)19111516(21)20(18(24)2515)127324812h21119H1H3b1511+
methyl2(((E)(4oxo3phenyl2sulfanylidene13thiazolidin5ylidene)methyl)amino)benzoate
methyl2(((E)(4oxo3phenyl2thioxo13thiazolidin5ylidene)methyl)amino)benzoate
MFCD09858444
ZINC000013734147
ZINC13734147

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Available files

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