Vitas-M small molecule compound

1-{6-[(5Z)-5-[4-(diethylamino)benzylidene]-2,4,6-trioxotetrahydropyrimidin-1(2H)-yl]hexyl}urea

Catalog ID
STL321870
SMILES CCN(c1ccc(cc1)/C=C\1/C(=O)NC(=O)N(C1=O)CCCCCCNC(=O)N)CC

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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 C22H31N5O4 MW 429.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H31N5O4/c1-3-26(4-2)17-11-9-16(10-12-17)15-18-19(28)25-22(31)27(20(18)29)14-8-6-5-7-13-24-21(23)30/h9-12,15H,3-8,13-14H2,1-2H3,(H3,23,24,30)(H,25,28,31)/b18-15-
InChIKey
INBMMJDYSREKKW-SDXDJHTJSA-N
Synonyms
302818-32-2
(Z)1(6(5(4(diethylamino)benzylidene)246trioxotetrahydropyrimidin1(2H)yl)hexyl)urea
1(6((5Z)5(4(diethylamino)benzylidene)246trioxotetrahydropyrimidin1(2H)yl)hexyl)urea
302818322
6((5Z)5((4(DIETHYLAMINO)PHENYL)METHYLIDENE)246TRIOXO13DIAZINAN1YL)HEXYLUREA
CCN(c1ccc(cc1)C=C1C(=O)NC(=O)N(C1=O)CCCCCCNC(=O)N)CC
CCN(CC)C1=CC=C(C=C1)C=C2C(=O)NC(=O)N(C2=O)CCCCCCNC(=O)N
InChI=1SC22H31N5O4c1326(42)1711916(101217)151819(28)2522(31)27(20(18)29)148657132421(23)30h91215H381314H212H3(H3232430)(H252831)b1815
MFCD01086540
ZINC000004733291
ZINC04733291
ZINC4733291

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Available files

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