Vitas-M small molecule compound

N-[(3-{[(3-chlorophenyl)carbonyl]amino}phenyl)carbamothioyl]-4-methoxy-3-nitrobenzamide

Catalog ID
STK139253
SMILES COc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1cccc(c1)NC(=O)c1cccc(c1)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 C22H17ClN4O5S MW 484.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17ClN4O5S/c1-32-19-9-8-14(11-18(19)27(30)31)21(29)26-22(33)25-17-7-3-6-16(12-17)24-20(28)13-4-2-5-15(23)10-13/h2-12H,1H3,(H,24,28)(H2,25,26,29,33)
InChIKey
UANZTONIXRVRNX-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC(=CC=C3)Cl)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1cccc(c1)NC(=O)c1cccc(c1)Cl
InChI=1SC22H17ClN4O5Sc132199814(1118(19)27(30)31)21(29)2622(33)251773616(1217)2420(28)1342515(23)1013h212H1H3(H2428)(H225262933)
MFCD02810901
N((3(((3CHLOROPHENYL)CARBONYL)AMINO)PHENYL)CARBAMOTHIOYL)4METHOXY3NITROBENZAMIDE
N((3((3CHLOROBENZOYL)AMINO)PHENYL)CARBAMOTHIOYL)4METHOXY3NITROBENZAMIDE
ZINC000009601604
ZINC09601604
ZINC9601604

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.