Vitas-M small molecule compound
(2E)-3-(3-nitrophenyl)-N-{2-[(thiophen-2-ylmethyl)sulfanyl]ethyl}prop-2-enamide
Catalog ID
STK089197
SMILES O=C(/C=C/c1cccc(c1)[N+](=O)[O-])NCCSCc1cccs1
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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 C16H16N2O3S2 MW 348.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O3S2/c19-16(17-8-10-22-12-15-5-2-9-23-15)7-6-13-3-1-4-14(11-13)18(20)21/h1-7,9,11H,8,10,12H2,(H,17,19)/b7-6+InChIKey
HUCPARLUGBTDIG-VOTSOKGWSA-NSynonyms
(2E)3(3NITROPHENYL)N(2((THIOPHEN2YLMETHYL)SULFANYL)ETHYL)PROP2ENAMIDE
(2E)3(3NITROPHENYL)N(2(2THIENYLMETHYLTHIO)ETHYL)PROP2ENAMIDE
(E)3(3NITROPHENYL)N(2(THIOPHEN2YLMETHYLSULFANYL)ETHYL)PROP2ENAMIDE
C1=CC(=CC(=C1)(N+)(=O)(O))C=CC(=O)NCCSCC2=CC=CS2
InChI=1SC16H16N2O3S2c1916(178102212155292315)761331414(1113)18(20)21h17911H81012H2(H1719)b76+
MFCD03552602
O=C(C=Cc1cccc(c1)(N+)(=O)(O))NCCSCc1cccs1
STK089197
ZINC000004544720
ZINC04544720
ZINC4544720
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