Vitas-M small molecule compound

N-[(3-chloro-4-methylphenyl)carbamothioyl]-4-methyl-3-nitrobenzamide

Catalog ID
STK141268
SMILES S=C(NC(=O)c1ccc(c(c1)[N+](=O)[O-])C)Nc1ccc(c(c1)Cl)C

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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 C16H14ClN3O3S MW 363.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClN3O3S/c1-9-4-6-12(8-13(9)17)18-16(24)19-15(21)11-5-3-10(2)14(7-11)20(22)23/h3-8H,1-2H3,(H2,18,19,21,24)
InChIKey
VLHMLIXIZHKIBE-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)C)Cl)(N+)(=O)(O)
InChI=1SC16H14ClN3O3Sc194612(813(9)17)1816(24)1915(21)115310(2)14(711)20(22)23h38H12H3(H218192124)
MFCD02631900
N((3CHLORO4METHYLPHENYL)CARBAMOTHIOYL)4METHYL3NITROBENZAMIDE
S=C(NC(=O)c1ccc(c(c1)(N+)(=O)(O))C)Nc1ccc(c(c1)Cl)C
ZINC000001174262
ZINC01174262
ZINC1174262

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Available files

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