Vitas-M small molecule compound
(2E)-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-(3-nitrophenyl)prop-2-enamide
Catalog ID
STK107438
SMILES O=C(NC(=S)Nc1ccc2c3c1cccc3CC2)/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 C22H17N3O3S MW 403.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O3S/c26-20(12-7-14-3-1-5-17(13-14)25(27)28)24-22(29)23-19-11-10-16-9-8-15-4-2-6-18(19)21(15)16/h1-7,10-13H,8-9H2,(H2,23,24,26,29)/b12-7+InChIKey
BXTINENBWXUBTM-KPKJPENVSA-NSynonyms
(2E)N((ACENAPHTHEN5YLAMINO)THIOXOMETHYL)3(3NITROPHENYL)PROP2ENAMIDE
(2E)N(12DIHYDROACENAPHTHYLEN5YLCARBAMOTHIOYL)3(3NITROPHENYL)PROP2ENAMIDE
(E)N(12DIHYDROACENAPHTHYLEN5YLCARBAMOTHIOYL)3(3NITROPHENYL)PROP2ENAMIDE
C1CC2=CC=CC3=C(C=CC1=C23)NC(=S)NC(=O)C=CC4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC22H17N3O3Sc2620(1271431517(1314)25(27)28)2422(29)2319111016981542618(19)21(15)16h171013H89H2(H223242629)b127+
MFCD03037506
O=C(NC(=S)Nc1ccc2c3c1cccc3CC2)C=Cc1cccc(c1)(N+)(=O)(O)
ZINC000001182506
ZINC01182506
ZINC1182506
Check stock
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