Vitas-M small molecule compound

3-methyl-2-octyl-1-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}pyrido[1,2-a]benzimidazole-4-carbonitrile

Catalog ID
STK531991
SMILES CCCCCCCCc1c(C)c(C#N)c2n(c1N1CCN(CC1)C/C=C/c1ccccc1)c1ccccc1n2

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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 C34H41N5 MW 519.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H41N5/c1-3-4-5-6-7-11-18-29-27(2)30(26-35)33-36-31-19-12-13-20-32(31)39(33)34(29)38-24-22-37(23-25-38)21-14-17-28-15-9-8-10-16-28/h8-10,12-17,19-20H,3-7,11,18,21-25H2,1-2H3/b17-14+
InChIKey
WMBAZZALXUPHRU-SAPNQHFASA-N
Synonyms
305335-38-0
(E)1(4cinnamylpiperazin1yl)3methyl2octylbenzo(45)imidazo(12a)pyridine4carbonitrile
305335380
3methyl2octyl1(4((2E)3phenylprop2en1yl)piperazin1yl)pyrido(12a)benzimidazole4carbonitrile
3METHYL2OCTYL1(4((E)3PHENYLPROP2ENYL)PIPERAZIN1YL)PYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
CCCCCCCCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)N4CCN(CC4)CC=CC5=CC=CC=C5
CCCCCCCCc1c(C)c(C#N)c2n(c1N1CCN(CC1)CC=Cc1ccccc1)c1ccccc1n2
InChI=1SC34H41N5c13456711182927(2)30(2635)3336311912132032(31)39(33)34(29)38242237(232538)211417281598101628h81012171920H3711182125H212H3b1714+
MFCD01912701
ZINC000100692958
ZINC100692958

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Available files

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