Vitas-M small molecule compound

methyl 2-{[(E)-2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]amino}benzoate

Catalog ID
STK537690
SMILES N#C/C(=C\Nc1ccccc1C(=O)OC)/c1scc(n1)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 C20H15N3O2S MW 361.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N3O2S/c1-25-20(24)16-9-5-6-10-17(16)22-12-15(11-21)19-23-18(13-26-19)14-7-3-2-4-8-14/h2-10,12-13,22H,1H3/b15-12+
InChIKey
OIVPJVVTZZQTFH-NTCAYCPXSA-N
Synonyms

(E)methyl2((2cyano2(4phenylthiazol2yl)vinyl)amino)benzoate
COC(=O)C1=CC=CC=C1NC=C(C#N)C2=NC(=CS2)C3=CC=CC=C3
InChI=1SC20H15N3O2Sc12520(24)169561017(16)221215(1121)192318(132619)147324814h210121322H1H3b1512+
methyl2(((E)2cyano2(4phenyl13thiazol2yl)ethenyl)amino)benzoate
MFCD02984942
N#CC(=CNc1ccccc1C(=O)OC)c1scc(n1)c1ccccc1
ZINC000004819339
ZINC04819339
ZINC4819339

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Available files

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