Vitas-M small molecule compound

N-[(1Z)-1-(3,4-dimethoxyphenyl)-3-{[3-(morpholin-4-yl)propyl]amino}-3-oxoprop-1-en-2-yl]benzamide

Catalog ID
STK835590
SMILES COc1cc(ccc1OC)/C=C(/C(=O)NCCCN1CCOCC1)\NC(=O)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 C25H31N3O5 MW 453.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O5/c1-31-22-10-9-19(18-23(22)32-2)17-21(27-24(29)20-7-4-3-5-8-20)25(30)26-11-6-12-28-13-15-33-16-14-28/h3-5,7-10,17-18H,6,11-16H2,1-2H3,(H,26,30)(H,27,29)/b21-17-
InChIKey
JYFPSBCUIXSNQQ-FXBPSFAMSA-N
Synonyms
331454-72-9
(2Z)3(34DIMETHOXYPHENYL)N(3(MORPHOLIN4YL)PROPYL)2(PHENYLFORMAMIDO)PROP2ENAMIDE
(2Z)3(34DIMETHOXYPHENYL)N(3MORPHOLIN4YLPROPYL)2(PHENYLCARBONYLAMINO)PROP2ENAMIDE
(Z)N(1(34dimethoxyphenyl)3((3morpholinopropyl)amino)3oxoprop1en2yl)benzamide
331454729
COC1=C(C=C(C=C1)C=C(C(=O)NCCCN2CCOCC2)NC(=O)C3=CC=CC=C3)OC
COc1cc(ccc1OC)C=C(C(=O)NCCCN1CCOCC1)NC(=O)c1ccccc1
InChI=1SC25H31N3O5c1312210919(1823(22)322)1721(2724(29)207435820)25(30)261161228131533161428h357101718H61116H212H3(H2630)(H2729)b2117
MFCD01944861
N((1Z)1(34dimethoxyphenyl)3((3(morpholin4yl)propyl)amino)3oxoprop1en2yl)benzamide
N((Z)1(34DIMETHOXYPHENYL)3(3MORPHOLIN4YLPROPYLAMINO)3OXOPROP1EN2YL)BENZAMIDE
ZINC000019898700
ZINC19898700

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Available files

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