Vitas-M small molecule compound
4-chloro-N-[(4-methyl-2-nitrophenyl)carbamothioyl]benzamide
Catalog ID
STK016519
SMILES S=C(Nc1ccc(cc1[N+](=O)[O-])C)NC(=O)c1ccc(cc1)Cl
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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 C15H12ClN3O3S MW 349.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12ClN3O3S/c1-9-2-7-12(13(8-9)19(21)22)17-15(23)18-14(20)10-3-5-11(16)6-4-10/h2-8H,1H3,(H2,17,18,20,23)InChIKey
AECGINLTTUIKSQ-UHFFFAOYSA-NSynonyms
4CHLORON((4METHYL2NITROPHENYL)CARBAMOTHIOYL)BENZAMIDE
CC1=CC(=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)Cl)(N+)(=O)(O)
InChI=1SC15H12ClN3O3Sc192712(13(89)19(21)22)1715(23)1814(20)103511(16)6410h28H1H3(H217182023)
MFCD02637451
S=C(Nc1ccc(cc1(N+)(=O)(O))C)NC(=O)c1ccc(cc1)Cl
STK016519
ZINC000004560854
ZINC04560854
ZINC4560854
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