Vitas-M small molecule compound
2-({[(3-nitrophenyl)carbonyl]carbamothioyl}amino)-N-phenylbenzamide
Catalog ID
STL062509
SMILES S=C(Nc1ccccc1C(=O)Nc1ccccc1)NC(=O)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 C21H16N4O4S MW 420.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N4O4S/c26-19(14-7-6-10-16(13-14)25(28)29)24-21(30)23-18-12-5-4-11-17(18)20(27)22-15-8-2-1-3-9-15/h1-13H,(H,22,27)(H2,23,24,26,30)InChIKey
VCUMQBWUEULJNT-UHFFFAOYSA-NSynonyms
2((((3nitrophenyl)carbonyl)carbamothioyl)amino)Nphenylbenzamide
2((3NITROBENZOYL)CARBAMOTHIOYLAMINO)NPHENYLBENZAMIDE
C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC21H16N4O4Sc2619(14761016(1314)25(28)29)2421(30)231812541117(18)20(27)22158213915h113H(H2227)(H223242630)
MFCD03587243
S=C(Nc1ccccc1C(=O)Nc1ccccc1)NC(=O)c1cccc(c1)(N+)(=O)(O)
ZINC000001131101
ZINC01131101
ZINC1131101
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