Vitas-M small molecule compound

3-methyl-N-[(4-{4-[(4-methylphenyl)carbonyl]piperazin-1-yl}phenyl)carbamothioyl]benzamide

Catalog ID
STK255421
SMILES S=C(NC(=O)c1cccc(c1)C)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 C27H28N4O2S MW 472.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O2S/c1-19-6-8-21(9-7-19)26(33)31-16-14-30(15-17-31)24-12-10-23(11-13-24)28-27(34)29-25(32)22-5-3-4-20(2)18-22/h3-13,18H,14-17H2,1-2H3,(H2,28,29,32,34)
InChIKey
LDJLIPOUQPDGMG-UHFFFAOYSA-N
Synonyms

(3METHYLPHENYL)N(((4(4((4METHYLPHENYL)CARBONYL)PIPERAZINYL)PHENYL)AMINO)THIOXOMETHYL)CARBOXAMIDE
3methylN((4(4((4methylphenyl)carbonyl)piperazin1yl)phenyl)carbamothioyl)benzamide
3METHYLN((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)C
InChI=1SC27H28N4O2Sc1196821(9719)26(33)31161430(151731)24121023(111324)2827(34)2925(32)2253420(2)1822h31318H1417H212H3(H228293234)
MFCD03836983
ZINC000004122871
ZINC04122871
ZINC4122871

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Available files

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