Vitas-M small molecule compound
N-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]carbonothioyl}-3,4,5-triethoxybenzamide
Catalog ID
STK004530
SMILES CCOc1cc(cc(c1OCC)OCC)C(=O)NC(=S)N1CCN(CC1)c1ccc(cc1Cl)[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 C24H29ClN4O6S MW 537.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29ClN4O6S/c1-4-33-20-13-16(14-21(34-5-2)22(20)35-6-3)23(30)26-24(36)28-11-9-27(10-12-28)19-8-7-17(29(31)32)15-18(19)25/h7-8,13-15H,4-6,9-12H2,1-3H3,(H,26,30,36)InChIKey
UQILZDDJDIFFFW-UHFFFAOYSA-NSynonyms
CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)N2CCN(CC2)C3=C(C=C(C=C3)(N+)(=O)(O))Cl
CCOc1cc(cc(c1OCC)OCC)C(=O)NC(=S)N1CCN(CC1)c1ccc(cc1Cl)(N+)(=O)(O)
InChI=1SC24H29ClN4O6Sc1433201316(1421(3452)22(20)3563)23(30)2624(36)2811927(101228)198717(29(31)32)1518(19)25h781315H46912H213H3(H263036)
MFCD02603091
N((4(2CHLORO4NITROPHENYL)PIPERAZIN1YL)CARBONOTHIOYL)345TRIETHOXYBENZAMIDE
N(4(2CHLORO4NITROPHENYL)PIPERAZINE1CARBOTHIOYL)345TRIETHOXYBENZAMIDE
STK004530
ZINC000004089873
ZINC4089873
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