Vitas-M small molecule compound
3-chloro-N-[(4-{4-[(4-methylphenyl)carbonyl]piperazin-1-yl}phenyl)carbamothioyl]benzamide
Catalog ID
STK255423
SMILES S=C(NC(=O)c1cccc(c1)Cl)Nc1ccc(cc1)N1CCN(CC1)C(=O)c1ccc(cc1)C
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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 C26H25ClN4O2S MW 493.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN4O2S/c1-18-5-7-19(8-6-18)25(33)31-15-13-30(14-16-31)23-11-9-22(10-12-23)28-26(34)29-24(32)20-3-2-4-21(27)17-20/h2-12,17H,13-16H2,1H3,(H2,28,29,32,34)InChIKey
ANQBGFXQRXSELI-UHFFFAOYSA-NSynonyms
(3CHLOROPHENYL)N(((4(4((4METHYLPHENYL)CARBONYL)PIPERAZINYL)PHENYL)AMINO)THIOXOMETHYL)CARBOXAMIDE
3chloroN((4(4((4methylphenyl)carbonyl)piperazin1yl)phenyl)carbamothioyl)benzamide
3CHLORON((4(4(4METHYLBENZOYL)PIPERAZIN1YL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC(=CC=C4)Cl
InChI=1SC26H25ClN4O2Sc1185719(8618)25(33)31151330(141631)2311922(101223)2826(34)2924(32)2032421(27)1720h21217H1316H21H3(H228293234)
MFCD03836992
ZINC000004122880
ZINC04122880
ZINC4122880
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