Vitas-M small molecule compound

2-{[2-bromo-4-(propan-2-yl)phenoxy]acetyl}-N-phenylhydrazinecarbothioamide

Catalog ID
STL062922
SMILES O=C(COc1ccc(cc1Br)C(C)C)NNC(=S)Nc1ccccc1

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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 C18H20BrN3O2S MW 422.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20BrN3O2S/c1-12(2)13-8-9-16(15(19)10-13)24-11-17(23)21-22-18(25)20-14-6-4-3-5-7-14/h3-10,12H,11H2,1-2H3,(H,21,23)(H2,20,22,25)
InChIKey
UMIAHEJKRDUUKY-UHFFFAOYSA-N
Synonyms

1((2(2BROMO4PROPAN2YLPHENOXY)ACETYL)AMINO)3PHENYLTHIOUREA
2((2bromo4(propan2yl)phenoxy)acetyl)Nphenylhydrazinecarbothioamide
CC(C)C1=CC(=C(C=C1)OCC(=O)NNC(=S)NC2=CC=CC=C2)Br
InChI=1SC18H20BrN3O2Sc112(2)138916(15(19)1013)241117(23)212218(25)20146435714h31012H11H212H3(H2123)(H2202225)
MFCD03876087
ZINC000002861681
ZINC02861681
ZINC2861681

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Available files

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