Vitas-M small molecule compound
2-chloro-5-iodo-N-[(2-methoxy-4-nitrophenyl)carbamothioyl]benzamide
Catalog ID
STK018137
SMILES COc1cc(ccc1NC(=S)NC(=O)c1cc(I)ccc1Cl)[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 C15H11ClIN3O4S MW 491.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11ClIN3O4S/c1-24-13-7-9(20(22)23)3-5-12(13)18-15(25)19-14(21)10-6-8(17)2-4-11(10)16/h2-7H,1H3,(H2,18,19,21,25)InChIKey
DWPNVZMCQMRYHS-UHFFFAOYSA-NSynonyms
2CHLORO5IODON((2METHOXY4NITROPHENYL)CARBAMOTHIOYL)BENZAMIDE
COC1=C(C=CC(=C1)(N+)(=O)(O))NC(=S)NC(=O)C2=C(C=CC(=C2)I)Cl
COc1cc(ccc1NC(=S)NC(=O)c1cc(I)ccc1Cl)(N+)(=O)(O)
InChI=1SC15H11ClIN3O4Sc1241379(20(22)23)3512(13)1815(25)1914(21)1068(17)2411(10)16h27H1H3(H218192125)
MFCD03030827
STK018137
ZINC000008986232
ZINC08986232
ZINC8986232
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