Vitas-M small molecule compound
3-chloro-N-[4-({[(2E)-3-(3-nitrophenyl)prop-2-enoyl]carbamothioyl}amino)phenyl]benzamide
Catalog ID
STK139333
SMILES S=C(Nc1ccc(cc1)NC(=O)c1cccc(c1)Cl)NC(=O)/C=C/c1cccc(c1)[N+](=O)[O-]
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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 C23H17ClN4O4S MW 480.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17ClN4O4S/c24-17-5-2-4-16(14-17)22(30)25-18-8-10-19(11-9-18)26-23(33)27-21(29)12-7-15-3-1-6-20(13-15)28(31)32/h1-14H,(H,25,30)(H2,26,27,29,33)/b12-7+InChIKey
ZCCRVBQKBZSUJG-KPKJPENVSA-NSynonyms
3CHLORON(4((((2E)3(3NITROPHENYL)PROP2ENOYL)CARBAMOTHIOYL)AMINO)PHENYL)BENZAMIDE
3CHLORON(4(((E)3(3NITROPHENYL)PROP2ENOYL)CARBAMOTHIOYLAMINO)PHENYL)BENZAMIDE
C1=CC(=CC(=C1)(N+)(=O)(O))C=CC(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)Cl
InChI=1SC23H17ClN4O4Sc241752416(1417)22(30)251881019(11918)2623(33)2721(29)1271531620(1315)28(31)32h114H(H2530)(H226272933)b127+
MFCD03568528
S=C(Nc1ccc(cc1)NC(=O)c1cccc(c1)Cl)NC(=O)C=Cc1cccc(c1)(N+)(=O)(O)
ZINC000004090986
ZINC04090986
ZINC4090986
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