Vitas-M small molecule compound
4-methyl-3-nitro-N-{[2-(4-propanoylpiperazin-1-yl)phenyl]carbamothioyl}benzamide
Catalog ID
STK345121
SMILES CCC(=O)N1CCN(CC1)c1ccccc1NC(=S)NC(=O)c1ccc(c(c1)[N+](=O)[O-])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 C22H25N5O4S MW 455.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O4S/c1-3-20(28)26-12-10-25(11-13-26)18-7-5-4-6-17(18)23-22(32)24-21(29)16-9-8-15(2)19(14-16)27(30)31/h4-9,14H,3,10-13H2,1-2H3,(H2,23,24,29,32)InChIKey
WAVQFNLBCPLLJX-UHFFFAOYSA-NSynonyms
1(4METHYL3NITROBENZOYL)3(2(4PROPIONYLPIPERAZIN1YL)PHENYL)THIOUREA
4methyl3nitroN((2(4propanoylpiperazin1yl)phenyl)carbamothioyl)benzamide
CCC(=O)N1CCN(CC1)c1ccccc1NC(=S)NC(=O)c1ccc(c(c1)(N+)(=O)(O))C
CCC(=O)N1CCN(CC1)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=C(C=C3)C)(N+)(=O)(O)
InChI=1SC22H25N5O4Sc1320(28)26121025(111326)18754617(18)2322(32)2421(29)169815(2)19(1416)27(30)31h4914H31013H212H3(H223242932)
MFCD08120190
ZINC000012856378
ZINC12856378
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