Vitas-M small molecule compound
(2E)-N-[(3-methoxyphenyl)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide
Catalog ID
STK148436
SMILES COc1cccc(c1)NC(=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/c1-24-15-7-3-5-13(11-15)18-17(25)19-16(21)9-8-12-4-2-6-14(10-12)20(22)23/h2-11H,1H3,(H2,18,19,21,25)/b9-8+InChIKey
OURJPGQVWAGDJB-CMDGGOBGSA-NSynonyms
(2E)N((3METHOXYPHENYL)CARBAMOTHIOYL)3(3NITROPHENYL)PROP2ENAMIDE
(E)N((3METHOXYPHENYL)CARBAMOTHIOYL)3(3NITROPHENYL)PROP2ENAMIDE
COC1=CC=CC(=C1)NC(=S)NC(=O)C=CC2=CC(=CC=C2)(N+)(=O)(O)
COc1cccc(c1)NC(=S)NC(=O)C=Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC17H15N3O4Sc1241573513(1115)1817(25)1916(21)981242614(1012)20(22)23h211H1H3(H218192125)b98+
MFCD03137918
ZINC000001180114
ZINC01180114
ZINC1180114
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