Vitas-M small molecule compound
2-chloro-N-{[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]carbonothioyl}-4-methylbenzamide
Catalog ID
STK172640
SMILES Cc1ccc(c(c1)Cl)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 C19H18Cl2N4O3S MW 453.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18Cl2N4O3S/c1-12-2-4-14(15(20)10-12)18(26)22-19(29)24-8-6-23(7-9-24)17-5-3-13(25(27)28)11-16(17)21/h2-5,10-11H,6-9H2,1H3,(H,22,26,29)InChIKey
HXEPMAWBIKYWOA-UHFFFAOYSA-NSynonyms
2CHLORON((4(2CHLORO4NITROPHENYL)PIPERAZIN1YL)CARBONOTHIOYL)4METHYLBENZAMIDE
2CHLORON(4(2CHLORO4NITROPHENYL)PIPERAZINE1CARBOTHIOYL)4METHYLBENZAMIDE
CC1=CC(=C(C=C1)C(=O)NC(=S)N2CCN(CC2)C3=C(C=C(C=C3)(N+)(=O)(O))Cl)Cl
Cc1ccc(c(c1)Cl)C(=O)NC(=S)N1CCN(CC1)c1ccc(cc1Cl)(N+)(=O)(O)
InChI=1SC19H18Cl2N4O3Sc1122414(15(20)1012)18(26)2219(29)248623(7924)175313(25(27)28)1116(17)21h251011H69H21H3(H222629)
MFCD05830901
ZINC000009892035
ZINC09892035
ZINC9892035
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