Vitas-M small molecule compound
3-nitro-N-(2,2,2-trichloro-1-{[(2-hydroxyphenyl)carbamothioyl]amino}ethyl)benzamide
Catalog ID
STK808435
SMILES S=C(NC(C(Cl)(Cl)Cl)NC(=O)c1cccc(c1)[N+](=O)[O-])Nc1ccccc1O
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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 C16H13Cl3N4O4S MW 463.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13Cl3N4O4S/c17-16(18,19)14(22-15(28)20-11-6-1-2-7-12(11)24)21-13(25)9-4-3-5-10(8-9)23(26)27/h1-8,14,24H,(H,21,25)(H2,20,22,28)InChIKey
OBMQWQDMDTZWHF-UHFFFAOYSA-NSynonyms
3NITRON((1R)222TRICHLORO1(((2HYDROXYPHENYL)CARBAMOTHIOYL)AMINO)ETHYL)BENZAMIDE
3NITRON((1S)222TRICHLORO1(((2HYDROXYPHENYL)CARBAMOTHIOYL)AMINO)ETHYL)BENZAMIDE
3nitroN(222trichloro1(((2hydroxyphenyl)carbamothioyl)amino)ethyl)benzamide
3NITRON(222TRICHLORO1((2HYDROXYPHENYL)CARBAMOTHIOYLAMINO)ETHYL)BENZAMIDE
C1=CC=C(C(=C1)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C2=CC(=CC=C2)(N+)(=O)(O))O
InChI=1SC16H13Cl3N4O4Sc1716(1819)14(2215(28)2011612712(11)24)2113(25)943510(89)23(26)27h181424H(H2125)(H2202228)
MFCD00525910
S=C(NC(C(Cl)(Cl)Cl)NC(=O)c1cccc(c1)(N+)(=O)(O))Nc1ccccc1O
ZINC000001446563
ZINC000001446564
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