Vitas-M small molecule compound

(2E)-3-[3-methoxy-4-(naphthalen-2-ylmethoxy)phenyl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile

Catalog ID
STK183263
SMILES N#C/C(=C\c1ccc(c(c1)OC)OCc1ccc2c(c1)cccc2)/C(=O)N1CCN(CC1)c1ccccc1

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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 C32H29N3O3 MW 503.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29N3O3/c1-37-31-21-24(12-14-30(31)38-23-25-11-13-26-7-5-6-8-27(26)20-25)19-28(22-33)32(36)35-17-15-34(16-18-35)29-9-3-2-4-10-29/h2-14,19-21H,15-18,23H2,1H3/b28-19+
InChIKey
VSWFDBRDWMBPPW-TURZUDJPSA-N
Synonyms

(2E)3(3METHOXY4(2NAPHTHYLMETHOXY)PHENYL)2((4PHENYLPIPERAZINYL)CARBONYL)PROP2ENENITRILE
(2E)3(3METHOXY4(NAPHTHALEN2YLMETHOXY)PHENYL)2((4PHENYLPIPERAZIN1YL)CARBONYL)PROP2ENENITRILE
(E)3(3methoxy4(naphthalen2ylmethoxy)phenyl)2(4phenylpiperazine1carbonyl)acrylonitrile
(E)3(3METHOXY4(NAPHTHALEN2YLMETHOXY)PHENYL)2(4PHENYLPIPERAZINE1CARBONYL)PROP2ENENITRILE
COC1=C(C=CC(=C1)C=C(C#N)C(=O)N2CCN(CC2)C3=CC=CC=C3)OCC4=CC5=CC=CC=C5C=C4
InChI=1SC32H29N3O3c137312124(121430(31)382325111326756827(26)2025)1928(2233)32(36)35171534(161835)2993241029h2141921H151823H21H3b2819+
MFCD02194555
N#CC(=Cc1ccc(c(c1)OC)OCc1ccc2c(c1)cccc2)C(=O)N1CCN(CC1)c1ccccc1
ZINC000002307503
ZINC02307503
ZINC2307503

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.