Vitas-M small molecule compound

1,3-dicyclohexyl-5-{[(3-fluorobenzyl)amino](phenylamino)methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STL440553
SMILES Fc1cccc(c1)CNC(=C1C(=O)N(C2CCCCC2)C(=O)N(C1=O)C1CCCCC1)Nc1ccccc1

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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 C30H35FN4O3 MW 518.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35FN4O3/c31-22-12-10-11-21(19-22)20-32-27(33-23-13-4-1-5-14-23)26-28(36)34(24-15-6-2-7-16-24)30(38)35(29(26)37)25-17-8-3-9-18-25/h1,4-5,10-14,19,24-25,32-33H,2-3,6-9,15-18,20H2
InChIKey
FJXCIMJEPSBOFI-UHFFFAOYSA-N
Synonyms

13dicyclohexyl5(((3fluorobenzyl)amino)(phenylamino)methylidene)pyrimidine246(1H3H5H)trione
13DICYCLOHEXYL5((3FLUOROBENZYLAMINO)(PHENYLAMINO)METHYLENE)PYRIMIDINE246(1H3H5H)TRIONE
5(ANILINO((3FLUOROPHENYL)METHYLAMINO)METHYLIDENE)13DICYCLOHEXYL13DIAZINANE246TRIONE
C1CCC(CC1)N2C(=O)C(=C(NCC3=CC(=CC=C3)F)NC4=CC=CC=C4)C(=O)N(C2=O)C5CCCCC5
InChI=1SC30H35FN4O3c312212101121(1922)203227(3323134151423)2628(36)34(24156271624)30(38)35(29(26)37)25178391825h14510141924253233H2369151820H2
MFCD06243680
ZINC000008757483
ZINC8757483

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Available files

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