Vitas-M small molecule compound

2-(2-phenoxypropanoyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide

Catalog ID
STK400807
SMILES C=CCNC(=S)NNC(=O)C(Oc1ccccc1)C

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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 C13H17N3O2S MW 279.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3O2S/c1-3-9-14-13(19)16-15-12(17)10(2)18-11-7-5-4-6-8-11/h3-8,10H,1,9H2,2H3,(H,15,17)(H2,14,16,19)
InChIKey
VKLXXYCYLKIQFW-UHFFFAOYSA-N
Synonyms

1(2phenoxypropanoylamino)3prop2enylthiourea
2(2phenoxypropanoyl)N(prop2en1yl)hydrazinecarbothioamide
2PHENOXYN(((PROP2ENYLAMINO)THIOXOMETHYL)AMINO)PROPANAMIDE
CC(C(=O)NNC(=S)NCC=C)OC1=CC=CC=C1
InChI=1SC13H17N3O2Sc1391413(19)161512(17)10(2)18117546811h3810H19H22H3(H1517)(H2141619)
MFCD04057278
ZINC000006520912
ZINC000006524333

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Available files

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