Vitas-M small molecule compound

(2E)-N-[2-(1H-benzimidazol-2-yl)ethyl]-3-(3-methoxy-4-propoxyphenyl)prop-2-enamide

Catalog ID
STL332357
SMILES CCCOc1ccc(cc1OC)/C=C/C(=O)NCCc1nc2c([nH]1)cccc2

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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 C22H25N3O3 MW 379.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O3/c1-3-14-28-19-10-8-16(15-20(19)27-2)9-11-22(26)23-13-12-21-24-17-6-4-5-7-18(17)25-21/h4-11,15H,3,12-14H2,1-2H3,(H,23,26)(H,24,25)/b11-9+
InChIKey
IQUOQWOYRLRZKT-PKNBQFBNSA-N
Synonyms
292160-76-0
(2E)N(2(1Hbenzimidazol2yl)ethyl)3(3methoxy4propoxyphenyl)prop2enamide
(2E)N(2BENZIMIDAZOL2YLETHYL)3(3METHOXY4PROPOXYPHENYL)PROP2ENAMIDE
(E)N(2(1HBENZIMIDAZOL2YL)ETHYL)3(3METHOXY4PROPOXYPHENYL)PROP2ENAMIDE
(E)N(2(1Hbenzo(d)imidazol2yl)ethyl)3(3methoxy4propoxyphenyl)acrylamide
292160760
CCCOC1=C(C=C(C=C1)C=CC(=O)NCCC2=NC3=CC=CC=C3N2)OC
CCCOc1ccc(cc1OC)C=CC(=O)NCCc1nc2c((nH)1)cccc2
InChI=1SC22H25N3O3c1314281910816(1520(19)272)91122(26)231312212417645718(17)2521h41115H31214H212H3(H2326)(H2425)b119+
MFCD01911989
N(2(1HBENZOIMIDAZOL2YL)ETHYL)3(3METHOXY4PROPOXYPHENYL)ACRYLAMIDE
ZINC000013285271
ZINC13285271

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Available files

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