Vitas-M small molecule compound
N-{[5-chloro-2-(4-propanoylpiperazin-1-yl)phenyl]carbamothioyl}-4-(morpholin-4-yl)-3-nitrobenzamide
Catalog ID
STK389719
SMILES CCC(=O)N1CCN(CC1)c1ccc(cc1NC(=S)NC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCOCC1)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 C25H29ClN6O5S MW 561.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29ClN6O5S/c1-2-23(33)31-9-7-29(8-10-31)20-6-4-18(26)16-19(20)27-25(38)28-24(34)17-3-5-21(22(15-17)32(35)36)30-11-13-37-14-12-30/h3-6,15-16H,2,7-14H2,1H3,(H2,27,28,34,38)InChIKey
AVXMSLZBGMJQNS-UHFFFAOYSA-NSynonyms
CCC(=O)N1CCN(CC1)c1ccc(cc1NC(=S)NC(=O)c1ccc(c(c1)(N+)(=O)(O))N1CCOCC1)Cl
CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=S)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)(N+)(=O)(O)
InChI=1SC25H29ClN6O5Sc1223(33)319729(81031)206418(26)1619(20)2725(38)2824(34)173521(22(1517)32(35)36)30111337141230h361516H2714H21H3(H227283438)
MFCD06001040
N((5chloro2(4propanoylpiperazin1yl)phenyl)carbamothioyl)4(morpholin4yl)3nitrobenzamide
N((5CHLORO2(4PROPANOYLPIPERAZIN1YL)PHENYL)CARBAMOTHIOYL)4MORPHOLIN4YL3NITROBENZAMIDE
ZINC000059612440
ZINC59612440
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