Vitas-M small molecule compound
N-{(2R,4S)-1-[(2E)-3-(2-methoxyphenyl)prop-2-enoyl]-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl}-N-phenylacetamide
Catalog ID
STK015692
SMILES COc1ccccc1/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/c1-20-19-26(30(21(2)31)23-12-5-4-6-13-23)24-14-8-9-15-25(24)29(20)28(32)18-17-22-11-7-10-16-27(22)33-3/h4-18,20,26H,19H2,1-3H3/b18-17+/t20-,26+/m1/s1InChIKey
KLNJOOYGTTYIBO-FFWIPWSWSA-NSynonyms
CC1CC(C2=CC=CC=C2N1C(=O)C=CC3=CC=CC=C3OC)N(C4=CC=CC=C4)C(=O)C
COc1ccccc1C=CC(=O)N1(C@H)(C)C(C@@H)(c2c1cccc2)N(c1ccccc1)C(=O)C
InChI=1SC28H28N2O3c1201926(30(21(2)31)23125461323)2414891525(24)29(20)28(32)181722117101627(22)333h4182026H19H213H3b1817+t2026+m1s1
MFCD13368283
N((2R4S)1((2E)3(2methoxyphenyl)prop2enoyl)2methyl1234tetrahydroquinolin4yl)Nphenylacetamide
N((2R4S)1((E)3(2methoxyphenyl)prop2enoyl)2methyl34dihydro2Hquinolin4yl)Nphenylacetamide
STK015692
ZINC000008984425
ZINC08984425
ZINC8984425
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