Vitas-M small molecule compound

(2E)-N-[(2-methoxyphenyl)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide

Catalog ID
STK148435
SMILES COc1ccccc1NC(=S)NC(=O)/C=C/c1cccc(c1)[N+](=O)[O-]

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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 C17H15N3O4S MW 357.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O4S/c1-24-15-8-3-2-7-14(15)18-17(25)19-16(21)10-9-12-5-4-6-13(11-12)20(22)23/h2-11H,1H3,(H2,18,19,21,25)/b10-9+
InChIKey
OLUXTGFUTHODHI-MDZDMXLPSA-N
Synonyms

(2E)N((2METHOXYPHENYL)CARBAMOTHIOYL)3(3NITROPHENYL)PROP2ENAMIDE
(E)N((2METHOXYPHENYL)CARBAMOTHIOYL)3(3NITROPHENYL)PROP2ENAMIDE
COC1=CC=CC=C1NC(=S)NC(=O)C=CC2=CC(=CC=C2)(N+)(=O)(O)
COc1ccccc1NC(=S)NC(=O)C=Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC17H15N3O4Sc12415832714(15)1817(25)1916(21)1091254613(1112)20(22)23h211H1H3(H218192125)b109+
MFCD03138317
ZINC000001182791
ZINC01182791
ZINC1182791

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Available files

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