Vitas-M small molecule compound
2-chloro-N-{[4-(4-nitrophenyl)piperazin-1-yl]carbonothioyl}benzamide
Catalog ID
STK091863
SMILES S=C(N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])NC(=O)c1ccccc1Cl
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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 C18H17ClN4O3S MW 404.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN4O3S/c19-16-4-2-1-3-15(16)17(24)20-18(27)22-11-9-21(10-12-22)13-5-7-14(8-6-13)23(25)26/h1-8H,9-12H2,(H,20,24,27)InChIKey
GZQFMIBABLCMQK-UHFFFAOYSA-NSynonyms
2CHLORON((4(4NITROPHENYL)1PIPERAZINYL)CARBONOTHIOYL)BENZAMIDE
2CHLORON((4(4NITROPHENYL)PIPERAZIN1YL)CARBONOTHIOYL)BENZAMIDE
2CHLORON(4(4NITROPHENYL)PIPERAZINE1CARBOTHIOYL)BENZAMIDE
C1CN(CCN1C2=CC=C(C=C2)(N+)(=O)(O))C(=S)NC(=O)C3=CC=CC=C3Cl
InChI=1SC18H17ClN4O3Sc1916421315(16)17(24)2018(27)2211921(101222)135714(8613)23(25)26h18H912H2(H202427)
MFCD02221988
S=C(N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O))NC(=O)c1ccccc1Cl
STK091863
ZINC000004663505
ZINC04663505
ZINC4663505
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