Vitas-M small molecule compound
3-nitro-N-(2,2,2-trichloro-1-{[(2-methylphenyl)carbamothioyl]amino}ethyl)benzamide
Catalog ID
STK369336
SMILES S=C(NC(C(Cl)(Cl)Cl)NC(=O)c1cccc(c1)[N+](=O)[O-])Nc1ccccc1C
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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 C17H15Cl3N4O3S MW 461.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15Cl3N4O3S/c1-10-5-2-3-8-13(10)21-16(28)23-15(17(18,19)20)22-14(25)11-6-4-7-12(9-11)24(26)27/h2-9,15H,1H3,(H,22,25)(H2,21,23,28)InChIKey
ACMIWJCBTSIWOG-UHFFFAOYSA-NSynonyms
3NITRON((1S)222TRICHLORO1(((2METHYLPHENYL)CARBAMOTHIOYL)AMINO)ETHYL)BENZAMIDE
3nitroN(222trichloro1(((2methylphenyl)carbamothioyl)amino)ethyl)benzamide
3NITRON(222TRICHLORO1((2METHYLPHENYL)CARBAMOTHIOYLAMINO)ETHYL)BENZAMIDE
3NITRON(222TRICHLORO1(3OTOLYLTHIOUREIDO)ETHYL)BENZAMIDE
CC1=CC=CC=C1NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C2=CC(=CC=C2)(N+)(=O)(O)
InChI=1SC17H15Cl3N4O3Sc110523813(10)2116(28)2315(17(1819)20)2214(25)1164712(911)24(26)27h2915H1H3(H2225)(H2212328)
MFCD00349721
S=C(NC(C(Cl)(Cl)Cl)NC(=O)c1cccc(c1)(N+)(=O)(O))Nc1ccccc1C
ZINC000000939641
ZINC000000939642
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