Vitas-M small molecule compound
3,4,5-triethoxy-N-{[4-(4-nitrophenyl)piperazin-1-yl]carbonothioyl}benzamide
Catalog ID
STK066713
SMILES CCOc1cc(cc(c1OCC)OCC)C(=O)NC(=S)N1CCN(CC1)c1ccc(cc1)[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 C24H30N4O6S MW 502.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N4O6S/c1-4-32-20-15-17(16-21(33-5-2)22(20)34-6-3)23(29)25-24(35)27-13-11-26(12-14-27)18-7-9-19(10-8-18)28(30)31/h7-10,15-16H,4-6,11-14H2,1-3H3,(H,25,29,35)InChIKey
BIAUGUGNTGSEPI-UHFFFAOYSA-NSynonyms
345TRIETHOXYN((4(4NITROPHENYL)PIPERAZIN1YL)CARBONOTHIOYL)BENZAMIDE
345TRIETHOXYN(4(4NITROPHENYL)PIPERAZINE1CARBOTHIOYL)BENZAMIDE
CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)(N+)(=O)(O)
CCOc1cc(cc(c1OCC)OCC)C(=O)NC(=S)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC24H30N4O6Sc1432201517(1621(3352)22(20)3463)23(29)2524(35)27131126(121427)187919(10818)28(30)31h7101516H461114H213H3(H252935)
MFCD02914579
N((4(4NITROPHENYL)PIPERAZINYL)THIOXOMETHYL)(345TRIETHOXYPHENYL)CARBOXAMIDE
STK066713
ZINC000004089856
ZINC04089856
ZINC4089856
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