Vitas-M small molecule compound
2-chloro-N-({4-[4-nitro-3-(piperidin-1-yl)phenyl]piperazin-1-yl}carbonothioyl)benzamide
Catalog ID
STK155694
SMILES S=C(N1CCN(CC1)c1ccc(c(c1)N1CCCCC1)[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 C23H26ClN5O3S MW 488.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26ClN5O3S/c24-19-7-3-2-6-18(19)22(30)25-23(33)28-14-12-26(13-15-28)17-8-9-20(29(31)32)21(16-17)27-10-4-1-5-11-27/h2-3,6-9,16H,1,4-5,10-15H2,(H,25,30,33)InChIKey
DCVJANSEVFPAOL-UHFFFAOYSA-NSynonyms
(2CHLOROPHENYL)N((4(4NITRO3PIPERIDYLPHENYL)PIPERAZINYL)THIOXOMETHYL)CARBOXAMIDE
2CHLORON((4(4NITRO3(PIPERIDIN1YL)PHENYL)PIPERAZIN1YL)CARBONOTHIOYL)BENZAMIDE
2CHLORON(4(4NITRO3PIPERIDIN1YLPHENYL)PIPERAZINE1CARBOTHIOYL)BENZAMIDE
C1CCN(CC1)C2=C(C=CC(=C2)N3CCN(CC3)C(=S)NC(=O)C4=CC=CC=C4Cl)(N+)(=O)(O)
InChI=1SC23H26ClN5O3Sc2419732618(19)22(30)2523(33)28141226(131528)178920(29(31)32)21(1617)27104151127h236916H1451015H2(H253033)
MFCD06662827
S=C(N1CCN(CC1)c1ccc(c(c1)N1CCCCC1)(N+)(=O)(O))NC(=O)c1ccccc1Cl
ZINC000004125342
ZINC04125342
ZINC4125342
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