Vitas-M small molecule compound
N-(1,3-benzothiazol-2-ylcarbamothioyl)-4-methoxy-3-nitrobenzamide
Catalog ID
STK101536
SMILES COc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1nc2c(s1)cccc2
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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 C16H12N4O4S2 MW 388.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N4O4S2/c1-24-12-7-6-9(8-11(12)20(22)23)14(21)18-15(25)19-16-17-10-4-2-3-5-13(10)26-16/h2-8H,1H3,(H2,17,18,19,21,25)InChIKey
GMCWMAQABOSROP-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC3=CC=CC=C3S2)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1nc2c(s1)cccc2
InChI=1SC16H12N4O4S2c12412769(811(12)20(22)23)14(21)1815(25)19161710423513(10)2616h28H1H3(H21718192125)
MFCD02810817
N((BENZOTHIAZOL2YLAMINO)THIOXOMETHYL)(4METHOXY3NITROPHENYL)CARBOXAMIDE
N(13BENZOTHIAZOL2YLCARBAMOTHIOYL)4METHOXY3NITROBENZAMIDE
ZINC000003770717
ZINC03770717
ZINC3770717
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