Vitas-M small molecule compound

(2E)-N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-3-(2-methoxyphenyl)prop-2-enamide

Catalog ID
STL118359
SMILES COc1ccccc1/C=C/C(=O)NCCSc1ccc(cc1)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 C18H18ClNO2S MW 347.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClNO2S/c1-22-17-5-3-2-4-14(17)6-11-18(21)20-12-13-23-16-9-7-15(19)8-10-16/h2-11H,12-13H2,1H3,(H,20,21)/b11-6+
InChIKey
KRDGGJNVCZWNES-IZZDOVSWSA-N
Synonyms

(2E)N(2((4chlorophenyl)sulfanyl)ethyl)3(2methoxyphenyl)prop2enamide
(E)N(2(4CHLOROPHENYL)SULFANYLETHYL)3(2METHOXYPHENYL)PROP2ENAMIDE
COC1=CC=CC=C1C=CC(=O)NCCSC2=CC=C(C=C2)Cl
COc1ccccc1C=CC(=O)NCCSc1ccc(cc1)Cl
InChI=1SC18H18ClNO2Sc12217532414(17)61118(21)20121323169715(19)81016h211H1213H21H3(H2021)b116+
MFCD03571934
ZINC000002815083
ZINC02815083
ZINC2815083

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Available files

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