Vitas-M small molecule compound

N-{(2R,4S)-1-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl}-N-phenylacetamide

Catalog ID
STL168517
SMILES COc1ccc(cc1)/C=C/C(=O)N1[C@H](C)C[C@@H](c2c1cccc2)N(c1ccccc1)C(=O)C

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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 C28H28N2O3 MW 440.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O3/c1-20-19-27(30(21(2)31)23-9-5-4-6-10-23)25-11-7-8-12-26(25)29(20)28(32)18-15-22-13-16-24(33-3)17-14-22/h4-18,20,27H,19H2,1-3H3/b18-15+/t20-,27+/m1/s1
InChIKey
RMUWWAKUMGWGLL-JPPXSRKMSA-N
Synonyms

(E)N(1(3(4methoxyphenyl)acryloyl)2methyl1234tetrahydroquinolin4yl)Nphenylacetamide
CC1CC(C2=CC=CC=C2N1C(=O)C=CC3=CC=C(C=C3)OC)N(C4=CC=CC=C4)C(=O)C
COc1ccc(cc1)C=CC(=O)N1(C@H)(C)C(C@@H)(c2c1cccc2)N(c1ccccc1)C(=O)C
COc1ccc(cc1)C=CC(=O)N1C(C)CC(c2c1cccc2)N(c1ccccc1)C(=O)C
InChI=1SC28H28N2O3c1201927(30(21(2)31)2395461023)2511781226(25)29(20)28(32)181522131624(333)171422h4182027H19H213H3b1815+t2027+m1s1
MFCD20731948
N((2R4S)1((2E)3(4methoxyphenyl)prop2enoyl)2methyl1234tetrahydroquinolin4yl)Nphenylacetamide
N((2R4S)1((E)3(4methoxyphenyl)prop2enoyl)2methyl34dihydro2Hquinolin4yl)Nphenylacetamide
ZINC000008767432
ZINC08767432
ZINC8767432

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Available files

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