Vitas-M small molecule compound

(2E)-N-{[2-(phenoxyacetyl)hydrazinyl]carbonothioyl}-3-phenylprop-2-enamide

Catalog ID
STK004205
SMILES O=C(COc1ccccc1)NNC(=S)NC(=O)/C=C/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 C18H17N3O3S MW 355.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O3S/c22-16(12-11-14-7-3-1-4-8-14)19-18(25)21-20-17(23)13-24-15-9-5-2-6-10-15/h1-12H,13H2,(H,20,23)(H2,19,21,22,25)/b12-11+
InChIKey
DQAJFYDDTHVEDV-VAWYXSNFSA-N
Synonyms

(2E)N((2(PHENOXYACETYL)HYDRAZINYL)CARBONOTHIOYL)3PHENYLPROP2ENAMIDE
(E)N(((2PHENOXYACETYL)AMINO)CARBAMOTHIOYL)3PHENYLPROP2ENAMIDE
C1=CC=C(C=C1)C=CC(=O)NC(=S)NNC(=O)COC2=CC=CC=C2
InChI=1SC18H17N3O3Sc2216(1211147314814)1918(25)212017(23)13241595261015h112H13H2(H2023)(H219212225)b1211+
MFCD01424682
O=C(COc1ccccc1)NNC(=S)NC(=O)C=Cc1ccccc1
STK004205
ZINC000004549672
ZINC04549672
ZINC4549672

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Available files

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